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(S)-elatadihydrochalcone

Family: Plantae - Leguminosae/Fabaceae
Kingdom: Plantae
Class: Flavonoid
- Subclass: Chalcone

Canonical Smiles	COc1cc2OC(C)(C)C=Cc2c(c1C(=O)C[C@@H](c1ccccc1)O)O
InChI	InChI=1S/C21H22O5/c1-21(2)10-9-14-17(26-21)12-18(25-3)19(20(14)24)16(23)11-15(22)13-7-5-4-6-8-13/h4-10,12,15,22,24H,11H2,1-3H3/t15-/m0/s1
InChIKey	NOMSQFAZUHRBTL-HNNXBMFYSA-N
Formula	C₂₁H₂₂O₅
HBA	5
HBD	2
MW	354.4
Rotatable Bonds	5
TPSA	75.99
LogP	3.89
Number Rings	3
Number Aromatic Rings	2
Heavy Atom Count	26
Formal Charge	0
Fraction CSP3	0.29
Exact Mass	354.15
Number of Lipinski Rule Violations	0

#	Species	Family	Kingdom	NCBI Taxonomy ID
1	Tephrosia elata	Leguminosae/Fabaceae	Plantae	1368159

Showing of synonyms

Muiva LM, Yenesew A, et al. (2009). Antiplasmodial β-hydroxydihydrochalcone from seedpods of Tephrosia elata. Phytochemistry Letters,2009,2(3),99-102. [View] [PubMed]

Pubchem: 162847623

Nmrshiftdb2: 70037844

No compound-protein relationship available.

SMILES: C1=CCOc(c12)ccc(c2)C(=O)CCc3ccccc3

Level: 1

Mol. Weight: 354.4 g/mol

SMILES: C1=CCOc(c12)cccc2

Level: 0

Mol. Weight: 354.4 g/mol

SMILES: c1ccccc1

Level: 0

Mol. Weight: 354.4 g/mol

Anti-plasmodial

Absorption

Caco-2 (logPapp): -4.5
Human Oral Bioavailability 20%: Bioavailable
Human Intestinal Absorption: Absorbed
Madin-Darby Canine Kidney: -4.600
Human Oral Bioavailability 50%: Bioavailable
P-Glycoprotein Inhibitor: Inhibitor
P-Glycoprotein Substrate: Non-Substrate
Skin Permeability: -1.85

Distribution

Blood-Brain Barrier (CNS): -
Blood-Brain Barrier: Penetrable
Fraction Unbound (Human): 1.160
Plasma Protein Binding: 69.74
Steady State Volume of Distribution: -

Metabolism

Breast Cancer Resistance Protein: Non-Inhibitor
CYP 1A2 Inhibitor: Inhibitor
CYP 1A2 Substrate: Substrate
CYP 2C19 Inhibitor: Inhibitor
CYP 2C19 Substrate: Substrate
CYP 2C9 Inhibitor: Non-Inhibitor
CYP 2C9 Substrate: Substrate
CYP 2D6 Inhibitor: Non-Inhibitor
CYP 2D6 Substrate: Non-Substrate
CYP 3A4 Inhibitor: Inhibitor
CYP 3A4 Substrate: Substrate
OATP1B1: Non-Inhibitor
OATP1B3: Non-Inhibitor

Excretion

Clearance: 7.480
Organic Cation Transporter 2: Non-Inhibitor
Half-Life of Drug: -

Toxicity

AMES Mutagenesis: Safe
Avian: Safe
Bee: Toxic
Bioconcentration Factor: 0.820
Biodegradation: Safe
Carcinogenesis: Safe
Crustacean: Toxic
Liver Injury I (DILI): Safe
Eye Corrosion: Safe
Eye Irritation: Safe
Maximum Tolerated Dose: 0.390
Liver Injury II: Toxic
hERG Blockers: Safe
Daphnia Maga: 5.530
Micronucleos: Toxic
NR-AhR: Toxic
NR-AR: Safe
NR-AR-LBD: Safe
NR-Aromatase: Safe
NR-ER: Safe
NR-ER-LBD: Safe
NR-GR: Safe
NR-PPAR-gamma: Safe
NR-TR: Safe
T. Pyriformis: -1.680
Rat (Acute): 2.730
Rat (Chronic Oral): 2.590
Fathead Minnow: 4.590
Respiratory Disease: Toxic
Skin Sensitisation: Safe
SR-ARE: Safe
SR-ATAD5: Safe
SR-HSE: Safe
SR-MMP: Toxic
SR-p53: Safe

General Properties

Boiling Point: 413.090
Hydration Free Energy: -9.310
Log(D) at pH=7.4: 3.250
Log(P): 4.06
Log S: -5.12
Log(Vapor Pressure): -7.62
Melting Point: 119.66
pKa Acid: 7.71
pKa Basic: 4.09

Protein Name	UniProt ID	Entry Name	Species	#Pharmacophore Points	Probability (0.7 ≤ Tversky Score ≤ 1.0)
Stromelysin-1	P08254	MMP3_HUMAN	Homo sapiens	3	0.9398
Stromelysin-1	P08254	MMP3_HUMAN	Homo sapiens	3	0.9398
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.9371
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.9371
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.9297
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.9297
Serine/threonine-protein kinase 24	Q9Y6E0	STK24_HUMAN	Homo sapiens	3	0.9270
Serine/threonine-protein kinase 24	Q9Y6E0	STK24_HUMAN	Homo sapiens	3	0.9270
Nuclear receptor subfamily 4immunitygroup A member 1	P22736	NR4A1_HUMAN	Homo sapiens	3	0.9257
Nuclear receptor subfamily 4immunitygroup A member 1	P22736	NR4A1_HUMAN	Homo sapiens	3	0.9257
Proton-gated ion channel	Q7NDN8	GLIC_GLOVI	Gloeobacter violaceus	3	0.9141
Proton-gated ion channel	Q7NDN8	GLIC_GLOVI	Gloeobacter violaceus	3	0.9141
Na(+):neurotransmitter symporter (Snf family)	O67854	O67854_AQUAE	Aquifex aeolicus	3	0.9103
Na(+):neurotransmitter symporter (Snf family)	O67854	O67854_AQUAE	Aquifex aeolicus	3	0.9103
Serpin domain-containing protein	H0ZQY2	H0ZQY2_TAEGU	Taeniopygia guttata	3	0.9097
Serpin domain-containing protein	H0ZQY2	H0ZQY2_TAEGU	Taeniopygia guttata	3	0.9097
Acetolactate synthase, chloroplastic	P17597	ILVB_ARATH	Arabidopsis thaliana	3	0.9091
Acetolactate synthase, chloroplastic	P17597	ILVB_ARATH	Arabidopsis thaliana	3	0.9091
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A	Q9QYJ6	PDE10_RAT	Rattus norvegicus	3	0.9066
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A	Q9QYJ6	PDE10_RAT	Rattus norvegicus	3	0.9066
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.9032
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.9032
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.8978
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.8978
Nuclear receptor subfamily 1 group I member 2	O75469	NR1I2_HUMAN	Homo sapiens	4	0.8972
Nuclear receptor subfamily 1 group I member 2	O75469	NR1I2_HUMAN	Homo sapiens	4	0.8972
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.8927
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.8927
Bromodomain-containing protein 2	P25440	BRD2_HUMAN	Homo sapiens	3	0.8898
Bromodomain-containing protein 2	P25440	BRD2_HUMAN	Homo sapiens	3	0.8898
Lactotransferrin	P24627	TRFL_BOVIN	Bos taurus	3	0.8876
Lactotransferrin	P24627	TRFL_BOVIN	Bos taurus	3	0.8876
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.8841
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.8841
Albumin	P02768	ALBU_HUMAN	Homo sapiens	3	0.8825
Albumin	P02768	ALBU_HUMAN	Homo sapiens	3	0.8825
Gag-Pol polyprotein	P12497	POL_HV1N5	Human immunodeficiency virus type 1 group M subtype B	3	0.8814
Gag-Pol polyprotein	P12497	POL_HV1N5	Human immunodeficiency virus type 1 group M subtype B	3	0.8814
Serine/threonine-protein kinase 10	O94804	STK10_HUMAN	Homo sapiens	3	0.8798
Serine/threonine-protein kinase 10	O94804	STK10_HUMAN	Homo sapiens	3	0.8798
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.8774
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.8774
Aldehyde dehydrogenase, dimeric NADP-preferring	P30838	AL3A1_HUMAN	Homo sapiens	3	0.8716
Aldehyde dehydrogenase, dimeric NADP-preferring	P30838	AL3A1_HUMAN	Homo sapiens	3	0.8716
Mitogen-activated protein kinase 8	P45983	MK08_HUMAN	Homo sapiens	3	0.8710
Mitogen-activated protein kinase 8	P45983	MK08_HUMAN	Homo sapiens	3	0.8710
Gag-Pol polyprotein	P04584	POL_HV2RO	Human immunodeficiency virus type 2 subtype A	4	0.8602
Gag-Pol polyprotein	P04584	POL_HV2RO	Human immunodeficiency virus type 2 subtype A	4	0.8602
Alpha-ketoglutarate-dependent dioxygenase FTO	Q9C0B1	FTO_HUMAN	Homo sapiens	3	0.8576
Alpha-ketoglutarate-dependent dioxygenase FTO	Q9C0B1	FTO_HUMAN	Homo sapiens	3	0.8576
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8565
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8565
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8529
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8529
3',5'-cyclic-AMP phosphodiesterase 4D	Q08499	PDE4D_HUMAN	Homo sapiens	4	0.8505
3',5'-cyclic-AMP phosphodiesterase 4D	Q08499	PDE4D_HUMAN	Homo sapiens	4	0.8505
Fibroblast growth factor receptor 1	P11362	FGFR1_HUMAN	Homo sapiens	3	0.8491
Fibroblast growth factor receptor 1	P11362	FGFR1_HUMAN	Homo sapiens	3	0.8491
UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase	Q8DNV6	Q8DNV6_STRR6	Streptococcus pneumoniae	3	0.8374
UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase	Q8DNV6	Q8DNV6_STRR6	Streptococcus pneumoniae	3	0.8374
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8283
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.8283
Matrix metalloproteinase-20	O60882	MMP20_HUMAN	Homo sapiens	3	0.8277
Matrix metalloproteinase-20	O60882	MMP20_HUMAN	Homo sapiens	3	0.8277
Serine/threonine-protein kinase pim-1	P11309	PIM1_HUMAN	Homo sapiens	3	0.8269
Serine/threonine-protein kinase pim-1	P11309	PIM1_HUMAN	Homo sapiens	3	0.8269
Beta-2-microglobulin	P61769	B2MG_HUMAN	Homo sapiens	3	0.8263
Beta-2-microglobulin	P61769	B2MG_HUMAN	Homo sapiens	3	0.8263
Mitogen-activated protein kinase 14	Q16539	MK14_HUMAN	Homo sapiens	3	0.8243
Mitogen-activated protein kinase 14	Q16539	MK14_HUMAN	Homo sapiens	3	0.8243
3',5'-cyclic-AMP phosphodiesterase 4D	Q08499	PDE4D_HUMAN	Homo sapiens	3	0.8201
3',5'-cyclic-AMP phosphodiesterase 4D	Q08499	PDE4D_HUMAN	Homo sapiens	3	0.8201
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.8177
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.8177
Chitinase A	Q9AMP1	Q9AMP1_VIBHA	Vibrio harveyi	3	0.8176
Chitinase A	Q9AMP1	Q9AMP1_VIBHA	Vibrio harveyi	3	0.8176
Matrilysin	P09237	MMP7_HUMAN	Homo sapiens	3	0.8163
Matrilysin	P09237	MMP7_HUMAN	Homo sapiens	3	0.8163
Genome polyprotein	O92972	POLG_HCVJ4	Hepatitis C virus genotype 1b	3	0.8132
Genome polyprotein	O92972	POLG_HCVJ4	Hepatitis C virus genotype 1b	3	0.8132
Lactoperoxidase	P80025	PERL_BOVIN	Bos taurus	3	0.8114
Lactoperoxidase	P80025	PERL_BOVIN	Bos taurus	3	0.8114
Cytochrome P450 1A1	P04798	CP1A1_HUMAN	Homo sapiens	3	0.8079
Cytochrome P450 1A1	P04798	CP1A1_HUMAN	Homo sapiens	3	0.8079
HTH-type transcriptional regulator QacR	P0A0N3	QACR_STAAM	Staphylococcus aureus	3	0.8020
HTH-type transcriptional regulator QacR	P0A0N3	QACR_STAAM	Staphylococcus aureus	3	0.8020
Acetylcholinesterase	P21836	ACES_MOUSE	Mus musculus	3	0.7999
Acetylcholinesterase	P21836	ACES_MOUSE	Mus musculus	3	0.7999
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7986
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7986
Beta-secretase 1	P56817	BACE1_HUMAN	Homo sapiens	2	0.7963
Beta-secretase 1	P56817	BACE1_HUMAN	Homo sapiens	2	0.7963
Tau-tubulin kinase 1	Q5TCY1	TTBK1_HUMAN	Homo sapiens	3	0.7846
Tau-tubulin kinase 1	Q5TCY1	TTBK1_HUMAN	Homo sapiens	3	0.7846
Polyribonucleotide nucleotidyltransferase	A7ZS61	PNP_ECO24	Escherichia coli O139:H28	3	0.7829
Polyribonucleotide nucleotidyltransferase	A7ZS61	PNP_ECO24	Escherichia coli O139:H28	3	0.7829
Replicase polyprotein 1ab	P0C6X7	R1AB_CVHSA	Human SARS coronavirus	3	0.7806
Replicase polyprotein 1ab	P0C6X7	R1AB_CVHSA	Human SARS coronavirus	3	0.7806
Acetylcholinesterase	P21836	ACES_MOUSE	Mus musculus	3	0.7795
Acetylcholinesterase	P21836	ACES_MOUSE	Mus musculus	3	0.7795
Dipeptidyl peptidase 4	P22411	DPP4_PIG	Sus scrofa	3	0.7761
Dipeptidyl peptidase 4	P22411	DPP4_PIG	Sus scrofa	3	0.7761
prolyl oligopeptidase	Q9X6R4	Q9X6R4_AERCA	Aeromonas caviae	2	0.7758
prolyl oligopeptidase	Q9X6R4	Q9X6R4_AERCA	Aeromonas caviae	2	0.7758
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7747
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7747
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A	Q9Y233	PDE10_HUMAN	Homo sapiens	3	0.7731
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A	Q9Y233	PDE10_HUMAN	Homo sapiens	3	0.7731
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	3	0.7727
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	3	0.7727
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	4	0.7706
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	4	0.7706
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7703
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7703
cGMP-dependent 3',5'-cyclic phosphodiesterase	O00408	PDE2A_HUMAN	Homo sapiens	3	0.7696
cGMP-dependent 3',5'-cyclic phosphodiesterase	O00408	PDE2A_HUMAN	Homo sapiens	3	0.7696
Mycinamicin III 3''-O-methyltransferase	Q49492	MYCF_MICGR	Micromonospora griseorubida	2	0.7677
Mycinamicin III 3''-O-methyltransferase	Q49492	MYCF_MICGR	Micromonospora griseorubida	2	0.7677
Phospholipase A2, major isoenzyme	P00592	PA21B_PIG	Sus scrofa	3	0.7654
Phospholipase A2, major isoenzyme	P00592	PA21B_PIG	Sus scrofa	3	0.7654
3',5'-cyclic-AMP phosphodiesterase 4B	Q07343	PDE4B_HUMAN	Homo sapiens	4	0.7643
3',5'-cyclic-AMP phosphodiesterase 4B	Q07343	PDE4B_HUMAN	Homo sapiens	4	0.7643
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7634
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7634
Stromelysin-1	P08254	MMP3_HUMAN	Homo sapiens	3	0.7629
Stromelysin-1	P08254	MMP3_HUMAN	Homo sapiens	3	0.7629
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	4	0.7609
Dipeptidyl peptidase 4	P27487	DPP4_HUMAN	Homo sapiens	4	0.7609
Gag-Pol polyprotein	P03367	POL_HV1BR	Human immunodeficiency virus type 1 group M subtype B	3	0.7592
Gag-Pol polyprotein	P03367	POL_HV1BR	Human immunodeficiency virus type 1 group M subtype B	3	0.7592
Abscisic acid receptor PYL2	O80992	PYL2_ARATH	Arabidopsis thaliana	3	0.7580
Abscisic acid receptor PYL2	O80992	PYL2_ARATH	Arabidopsis thaliana	3	0.7580
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7578
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7578
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7572
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7572
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7564
17beta-hydroxysteroid dehydrogenase	O93874	O93874_COCLU	Cochliobolus lunatus	3	0.7564
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7564
17beta-hydroxysteroid dehydrogenase	O93874	O93874_COCLU	Cochliobolus lunatus	3	0.7564
Anthocyanidin 3-O-glucosyltransferase UFGT	P51094	UFOG_VITVI	Vitis vinifera	4	0.7549
Anthocyanidin 3-O-glucosyltransferase UFGT	P51094	UFOG_VITVI	Vitis vinifera	4	0.7549
Flavin reductase like domain-containing protein	Q4UKE8	Q4UKE8_RICFE	Rickettsia felis	3	0.7531
Flavin reductase like domain-containing protein	Q4UKE8	Q4UKE8_RICFE	Rickettsia felis	3	0.7531
Death-associated protein kinase 1	P53355	DAPK1_HUMAN	Homo sapiens	3	0.7529
Death-associated protein kinase 1	P53355	DAPK1_HUMAN	Homo sapiens	3	0.7529
Albumin	P02768	ALBU_HUMAN	Homo sapiens	3	0.7506
Albumin	P02768	ALBU_HUMAN	Homo sapiens	3	0.7506
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	4	0.7500
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	4	0.7500
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7499
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7499
Serine/threonine-protein kinase PLK1	P53350	PLK1_HUMAN	Homo sapiens	3	0.7497
Serine/threonine-protein kinase PLK1	P53350	PLK1_HUMAN	Homo sapiens	3	0.7497
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7491
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7491
Apoptosis regulator Bcl-2	P10415	BCL2_HUMAN	Homo sapiens	3	0.7483
Apoptosis regulator Bcl-2	P10415	BCL2_HUMAN	Homo sapiens	3	0.7483
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.7474
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.7474
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.7474
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.7474
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7467
Carbonic anhydrase 2	P00918	CAH2_HUMAN	Homo sapiens	3	0.7467
Gag-Pol polyprotein	P04584	POL_HV2RO	Human immunodeficiency virus type 2 subtype A	4	0.7464
Gag-Pol polyprotein	P04584	POL_HV2RO	Human immunodeficiency virus type 2 subtype A	4	0.7464
Beta-secretase 1	P56817	BACE1_HUMAN	Homo sapiens	3	0.7459
Beta-secretase 1	P56817	BACE1_HUMAN	Homo sapiens	3	0.7459
Purine nucleoside phosphorylase DeoD-type	O34925	DEOD_BACSU	Bacillus subtilis	3	0.7457
Purine nucleoside phosphorylase DeoD-type	O34925	DEOD_BACSU	Bacillus subtilis	3	0.7457
Cyclin-dependent kinase 9	P50750	CDK9_HUMAN	Homo sapiens	3	0.7456
Cyclin-dependent kinase 9	P50750	CDK9_HUMAN	Homo sapiens	3	0.7456
Anthocyanidin 3-O-glucosyltransferase UFGT	P51094	UFOG_VITVI	Vitis vinifera	3	0.7443
Anthocyanidin 3-O-glucosyltransferase UFGT	P51094	UFOG_VITVI	Vitis vinifera	3	0.7443
11-beta-hydroxysteroid dehydrogenase 1	P28845	DHI1_HUMAN	Homo sapiens	3	0.7442
11-beta-hydroxysteroid dehydrogenase 1	P28845	DHI1_HUMAN	Homo sapiens	3	0.7442
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7441
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7441
Basic phospholipase A2 VRV-PL-VIIIa	P59071	PA2B8_DABRR	Daboia russelii	2	0.7434
Basic phospholipase A2 VRV-PL-VIIIa	P59071	PA2B8_DABRR	Daboia russelii	2	0.7434
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7422
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7422
NADPH-dependent oxidoreductase 2-alkenal reductase	Q39172	AER_ARATH	Arabidopsis thaliana	2	0.7410
NADPH-dependent oxidoreductase 2-alkenal reductase	Q39172	AER_ARATH	Arabidopsis thaliana	2	0.7410
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	3	0.7409
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	3	0.7409
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7407
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7407
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7407
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7407
D-aminoacyl-tRNA deacylase	Q8IIS0	DTD_PLAF7	Plasmodium falciparum	2	0.7405
D-aminoacyl-tRNA deacylase	Q8IIS0	DTD_PLAF7	Plasmodium falciparum	2	0.7405
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7403
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7403
Poly [ADP-ribose] polymerase tankyrase-1	O95271	TNKS1_HUMAN	Homo sapiens	3	0.7400
Poly [ADP-ribose] polymerase tankyrase-1	O95271	TNKS1_HUMAN	Homo sapiens	3	0.7400
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.7393
Methionine aminopeptidase 2	P50579	MAP2_HUMAN	Homo sapiens	3	0.7393
Chymotrypsinogen A	P00766	CTRA_BOVIN	Bos taurus	3	0.7384
Chymotrypsinogen A	P00766	CTRA_BOVIN	Bos taurus	3	0.7384
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	3	0.7383
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	3	0.7383
Pyridoxal kinase	P82197	PDXK_SHEEP	Ovis aries	3	0.7375
Pyridoxal kinase	P82197	PDXK_SHEEP	Ovis aries	3	0.7375
Caffeoyl-CoA O-methyltransferase	Q40313	CAMT_MEDSA	Medicago sativa	3	0.7363
Caffeoyl-CoA O-methyltransferase	Q40313	CAMT_MEDSA	Medicago sativa	3	0.7363
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7361
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7361
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.7352
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.7352
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7343
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7343
GCN5-related N-acetyltransferase	B1YEL6	B1YEL6_EXIS2	Exiguobacterium sibiricum	3	0.7336
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	4	0.7336
GCN5-related N-acetyltransferase	B1YEL6	B1YEL6_EXIS2	Exiguobacterium sibiricum	3	0.7336
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	4	0.7336
Glycogen synthase kinase-3 beta	P49841	GSK3B_HUMAN	Homo sapiens	3	0.7318
Glycogen synthase kinase-3 beta	P49841	GSK3B_HUMAN	Homo sapiens	3	0.7318
Genome polyprotein	P26663	POLG_HCVBK	Hepatitis C virus genotype 1b	3	0.7312
Genome polyprotein	P26663	POLG_HCVBK	Hepatitis C virus genotype 1b	3	0.7312
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7311
Heat shock protein HSP 90-alpha	P07900	HS90A_HUMAN	Homo sapiens	3	0.7311
GCN5-related N-acetyltransferase	B1YEL6	B1YEL6_EXIS2	Exiguobacterium sibiricum	3	0.7310
GCN5-related N-acetyltransferase	B1YEL6	B1YEL6_EXIS2	Exiguobacterium sibiricum	3	0.7310
Interstitial collagenase	P03956	MMP1_HUMAN	Homo sapiens	3	0.7309
Interstitial collagenase	P03956	MMP1_HUMAN	Homo sapiens	3	0.7309
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	3	0.7307
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	3	0.7307
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7300
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7300
CmeR	Q7B8P6	Q7B8P6_CAMJU	Campylobacter jejuni	3	0.7294
CmeR	Q7B8P6	Q7B8P6_CAMJU	Campylobacter jejuni	3	0.7294
HTH-type transcriptional regulator TtgR	Q9AIU0	TTGR_PSEPT	Pseudomonas putida	3	0.7278
HTH-type transcriptional regulator TtgR	Q9AIU0	TTGR_PSEPT	Pseudomonas putida	3	0.7278
Benzoylformate decarboxylase	P20906	MDLC_PSEPU	Pseudomonas putida	3	0.7267
Benzoylformate decarboxylase	P20906	MDLC_PSEPU	Pseudomonas putida	3	0.7267
Aldo-keto reductase family 1 member B1	P80276	ALDR_PIG	Sus scrofa	3	0.7267
Aldo-keto reductase family 1 member B1	P80276	ALDR_PIG	Sus scrofa	3	0.7267
Genome polyprotein	P26663	POLG_HCVBK	Hepatitis C virus genotype 1b	4	0.7250
Genome polyprotein	P26663	POLG_HCVBK	Hepatitis C virus genotype 1b	4	0.7250
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7248
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7248
Purine nucleoside phosphorylase DeoD-type	P0ABP9	DEOD_ECO57	Escherichia coli O157:H7	3	0.7247
Purine nucleoside phosphorylase DeoD-type	P0ABP9	DEOD_ECO57	Escherichia coli O157:H7	3	0.7247
Chalcone--flavanone isomerase 1	P28012	CFI1_MEDSA	Medicago sativa	3	0.7241
Mitochondrial poly(A) polymerase	F1NBW0	F1NBW0_CHICK	Gallus gallus	2	0.7241
Chalcone--flavanone isomerase 1	P28012	CFI1_MEDSA	Medicago sativa	3	0.7241
Mitochondrial poly(A) polymerase	F1NBW0	F1NBW0_CHICK	Gallus gallus	2	0.7241
Lactotransferrin	P24627	TRFL_BOVIN	Bos taurus	2	0.7237
Lactotransferrin	P24627	TRFL_BOVIN	Bos taurus	2	0.7237
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7236
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7236
Kinesin-like protein KIF11	P52732	KIF11_HUMAN	Homo sapiens	3	0.7232
Kinesin-like protein KIF11	P52732	KIF11_HUMAN	Homo sapiens	3	0.7232
Virulence sensor histidine kinase PhoQ	P0DM80	PHOQ_SALTY	Salmonella typhimurium	3	0.7228
Virulence sensor histidine kinase PhoQ	P0DM80	PHOQ_SALTY	Salmonella typhimurium	3	0.7228
Renin	P00797	RENI_HUMAN	Homo sapiens	3	0.7222
Renin	P00797	RENI_HUMAN	Homo sapiens	3	0.7222
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7208
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7208
4-hydroxyphenylacetate 3-monooxygenase, reductase component	Q5SJP7	HPAC_THET8	Thermus thermophilus	3	0.7200
4-hydroxyphenylacetate 3-monooxygenase, reductase component	Q5SJP7	HPAC_THET8	Thermus thermophilus	3	0.7200
TDP-4-oxo-6-deoxy-alpha-D-glucose-3,4-oxoisomerase	Q6T1W8	FDTA_ANETH	Aneurinibacillus thermoaerophilus	3	0.7188
TDP-4-oxo-6-deoxy-alpha-D-glucose-3,4-oxoisomerase	Q6T1W8	FDTA_ANETH	Aneurinibacillus thermoaerophilus	3	0.7188
Cystathionine gamma-synthase	P56069	METB_HELPY	Helicobacter pylori	3	0.7184
Cystathionine gamma-synthase	P56069	METB_HELPY	Helicobacter pylori	3	0.7184
Androgen receptor	P10275	ANDR_HUMAN	Homo sapiens	3	0.7182
Androgen receptor	P10275	ANDR_HUMAN	Homo sapiens	3	0.7182
Aldo-keto reductase family 1 member C3	P42330	AK1C3_HUMAN	Homo sapiens	2	0.7170
Tetracycline repressor protein class D	P0ACT4	TETR4_ECOLX	Escherichia coli	2	0.7170
Tetracycline repressor protein class D	P0ACT4	TETR4_ECOLX	Escherichia coli	2	0.7170
Aldo-keto reductase family 1 member C3	P42330	AK1C3_HUMAN	Homo sapiens	2	0.7170
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7163
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7163
Mycocyclosin synthase	P9WPP7	CP121_MYCTU	Mycobacterium tuberculosis	3	0.7159
Mycocyclosin synthase	P9WPP7	CP121_MYCTU	Mycobacterium tuberculosis	3	0.7159
Sodium-dependent dopamine transporter	Q7K4Y6	DAT_DROME	Drosophila melanogaster	2	0.7156
Sodium-dependent dopamine transporter	Q7K4Y6	DAT_DROME	Drosophila melanogaster	2	0.7156
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7156
Aldo-keto reductase family 1 member B1	P15121	ALDR_HUMAN	Homo sapiens	3	0.7156
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7152
Polymerase acidic protein	C3W5S0	C3W5S0_I09A0	Influenza A virus	2	0.7152
Polymerase acidic protein	C3W5S0	C3W5S0_I09A0	Influenza A virus	2	0.7152
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7152
Agglutinin alpha chain	P18674	LECA_MACPO	Maclura pomifera	3	0.7144
Agglutinin alpha chain	P18674	LECA_MACPO	Maclura pomifera	3	0.7144
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	3	0.7142
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	3	0.7142
Carbonyl reductase [NADPH] 1	P16152	CBR1_HUMAN	Homo sapiens	3	0.7137
Carbonyl reductase [NADPH] 1	P16152	CBR1_HUMAN	Homo sapiens	3	0.7137
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7135
Prothrombin	P00734	THRB_HUMAN	Homo sapiens	3	0.7135
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.7133
Thymidylate synthase	P00469	TYSY_LACCA	Lacticaseibacillus casei	3	0.7133
Chloramphenicol 3-O phosphotransferase	Q56148	CPT_STRVP	Streptomyces venezuelae	4	0.7126
Chloramphenicol 3-O phosphotransferase	Q56148	CPT_STRVP	Streptomyces venezuelae	4	0.7126
Subunit alpha of sarocosine oxidase	Q50LF0	Q50LF0_9CORY	Corynebacterium sp. U-96	3	0.7120
Subunit alpha of sarocosine oxidase	Q50LF0	Q50LF0_9CORY	Corynebacterium sp. U-96	3	0.7120
Tryptophan synthase alpha chain	P00929	TRPA_SALTY	Salmonella typhimurium	2	0.7117
Tryptophan synthase alpha chain	P00929	TRPA_SALTY	Salmonella typhimurium	2	0.7117
Norsolorinic acid synthase	Q12053	AFLC_ASPPU	Aspergillus parasiticus	2	0.7111
Norsolorinic acid synthase	Q12053	AFLC_ASPPU	Aspergillus parasiticus	2	0.7111
Peptidyl-prolyl cis-trans isomerase FKBP1A	P62942	FKB1A_HUMAN	Homo sapiens	2	0.7102
Peptidyl-prolyl cis-trans isomerase FKBP1A	P62942	FKB1A_HUMAN	Homo sapiens	2	0.7102
Aldo-keto reductase family 1 member D1	P51857	AK1D1_HUMAN	Homo sapiens	3	0.7096
Aldo-keto reductase family 1 member D1	P51857	AK1D1_HUMAN	Homo sapiens	3	0.7096
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7095
Poly [ADP-ribose] polymerase tankyrase-2	Q9H2K2	TNKS2_HUMAN	Homo sapiens	4	0.7095
Putative HMP/thiamine-binding protein YkoF	O34911	YKOF_BACSU	Bacillus subtilis	3	0.7094
Putative HMP/thiamine-binding protein YkoF	O34911	YKOF_BACSU	Bacillus subtilis	3	0.7094
Phospholipase A2, major isoenzyme	P00592	PA21B_PIG	Sus scrofa	3	0.7090
Phospholipase A2, major isoenzyme	P00592	PA21B_PIG	Sus scrofa	3	0.7090
Cathepsin S	P25774	CATS_HUMAN	Homo sapiens	3	0.7087
Cathepsin S	P25774	CATS_HUMAN	Homo sapiens	3	0.7087
5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase 1	O50008	METE1_ARATH	Arabidopsis thaliana	2	0.7084
5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase 1	O50008	METE1_ARATH	Arabidopsis thaliana	2	0.7084
Disintegrin and metalloproteinase domain-containing protein 17	P78536	ADA17_HUMAN	Homo sapiens	2	0.7083
Disintegrin and metalloproteinase domain-containing protein 17	P78536	ADA17_HUMAN	Homo sapiens	2	0.7083
Glycogen synthase kinase-3 beta	P49841	GSK3B_HUMAN	Homo sapiens	3	0.7083
Glycogen synthase kinase-3 beta	P49841	GSK3B_HUMAN	Homo sapiens	3	0.7083
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7082
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7082
Phosphoribosylformylglycinamidine synthase subunit PurL	Q9X0X3	PURL_THEMA	Thermotoga maritima	3	0.7076
Phosphoribosylformylglycinamidine synthase subunit PurL	Q9X0X3	PURL_THEMA	Thermotoga maritima	3	0.7076
HTH-type transcriptional repressor PurR	P0ACP7	PURR_ECOLI	Escherichia coli	3	0.7075
HTH-type transcriptional repressor PurR	P0ACP7	PURR_ECOLI	Escherichia coli	3	0.7075
Orotidine 5'-phosphate decarboxylase	Q9KQT7	PYRF_VIBCH	Vibrio cholerae serotype O1	4	0.7074
Orotidine 5'-phosphate decarboxylase	Q9KQT7	PYRF_VIBCH	Vibrio cholerae serotype O1	4	0.7074
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	2	0.7073
Steroid Delta-isomerase	P07445	SDIS_PSEPU	Pseudomonas putida	2	0.7073
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7059
Serine/threonine-protein kinase Chk1	O14757	CHK1_HUMAN	Homo sapiens	4	0.7059
Mitogen-activated protein kinase 1	P63086	MK01_RAT	Rattus norvegicus	3	0.7056
Mitogen-activated protein kinase 1	P63086	MK01_RAT	Rattus norvegicus	3	0.7056
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.7054
Epidermal growth factor receptor	P00533	EGFR_HUMAN	Homo sapiens	3	0.7054
Tyrosine-protein kinase Lck	P06239	LCK_HUMAN	Homo sapiens	3	0.7047
Tyrosine-protein kinase Lck	P06239	LCK_HUMAN	Homo sapiens	3	0.7047
Carbonic anhydrase 1	P00915	CAH1_HUMAN	Homo sapiens	2	0.7040
Carbonic anhydrase 1	P00915	CAH1_HUMAN	Homo sapiens	2	0.7040
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7038
Endothiapepsin	P11838	CARP_CRYPA	Cryphonectria parasitica	3	0.7038
Cytidine and deoxycytidylate deaminase zinc-binding region	Q82Y41	Q82Y41_NITEU	Nitrosomonas europaea	3	0.7036
Cytidine and deoxycytidylate deaminase zinc-binding region	Q82Y41	Q82Y41_NITEU	Nitrosomonas europaea	3	0.7036
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7030
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A	O76083	PDE9A_HUMAN	Homo sapiens	3	0.7030
4-hydroxyphenylacetate 3-monooxygenase	Q8YHT7	Q8YHT7_BRUME	Brucella melitensis biotype 1	2	0.7023
4-hydroxyphenylacetate 3-monooxygenase	Q8YHT7	Q8YHT7_BRUME	Brucella melitensis biotype 1	2	0.7023
Collagenase 3	P45452	MMP13_HUMAN	Homo sapiens	3	0.7021
Collagenase 3	P45452	MMP13_HUMAN	Homo sapiens	3	0.7021
Aldo-keto reductase family 1 member C2	P52895	AK1C2_HUMAN	Homo sapiens	3	0.7018
Tissue factor	P13726	TF_HUMAN	Homo sapiens	3	0.7018
Aldo-keto reductase family 1 member C2	P52895	AK1C2_HUMAN	Homo sapiens	3	0.7018
Tissue factor	P13726	TF_HUMAN	Homo sapiens	3	0.7018
Amino-acid acetyltransferase	Q5FAK7	Q5FAK7_NEIG1	Neisseria gonorrhoeae	2	0.7011
Amino-acid acetyltransferase	Q5FAK7	Q5FAK7_NEIG1	Neisseria gonorrhoeae	2	0.7011
11-beta-hydroxysteroid dehydrogenase 1	P28845	DHI1_HUMAN	Homo sapiens	3	0.7009
11-beta-hydroxysteroid dehydrogenase 1	P28845	DHI1_HUMAN	Homo sapiens	3	0.7009

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