4-hydroxy-2,3-dimethoxybenzophenone - Compound Card

4-hydroxy-2,3-dimethoxybenzophenone

Select a section from the left sidebar

4-hydroxy-2,3-dimethoxybenzophenone

Structure
Zoomed Structure
  • Family: Plantae - Polygalaceae
  • Kingdom: Plantae
  • Class: Benzenoid
    • Subclass: Benzophenone
Canonical Smiles COc1c(ccc(c1OC)O)C(=O)c1ccccc1
InChI InChI=1S/C15H14O4/c1-18-14-11(8-9-12(16)15(14)19-2)13(17)10-6-4-3-5-7-10/h3-9,16H,1-2H3
InChIKey MCDWVKGOMYTRRH-UHFFFAOYSA-N
Formula C15H14O4
HBA 4
HBD 1
MW 258.27
Rotatable Bonds 4
TPSA 55.76
LogP 2.64
Number Rings 2
Number Aromatic Rings 2
Heavy Atom Count 19
Formal Charge 0
Fraction CSP3 0.13
Exact Mass 258.09
Number of Lipinski Rule Violations 0
# Species Family Kingdom NCBI Taxonomy ID
1 Securidaca longipedunculata Polygalaceae Plantae 690845

Showing of synonyms

  • Ochora DO, Kakudidi E, et al. (2022). A new benzophenone, and the Antiplasmodial activities of the constituents of Securidaca longipedunculata fresen (Polygalaceae). Natural product research,2022, 36(11), 2758-2766. [View] [PubMed]
Pubchem: 23192357
Nmrshiftdb2: 70102894

No compound-protein relationship available.

Structure

SMILES: c1ccccc1C(=O)c2ccccc2

Level: 1

Mol. Weight: 258.27 g/mol

Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 258.27 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-4.54
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-4.320
Human Oral Bioavailability 50%
Bioavailable
P-Glycoprotein Inhibitor
Non-Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-2.51

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Penetrable
Fraction Unbound (Human)
0.940
Plasma Protein Binding
62.34
Steady State Volume of Distribution
-

Metabolism

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

Excretion

Clearance
6.850
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Safe
Bioconcentration Factor
1.720
Biodegradation
Safe
Carcinogenesis
Safe
Crustacean
Toxic
Liver Injury I (DILI)
Toxic
Eye Corrosion
Safe
Eye Irritation
Toxic
Maximum Tolerated Dose
1.370
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
5.640
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
3.910
Rat (Acute)
1.960
Rat (Chronic Oral)
2.360
Fathead Minnow
4.550
Respiratory Disease
Safe
Skin Sensitisation
Safe
SR-ARE
Safe
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Toxic
SR-p53
Safe

General Properties

Boiling Point
349.450
Hydration Free Energy
-8.640
Log(D) at pH=7.4
1.910
Log(P)
2.61
Log S
-4.06
Log(Vapor Pressure)
-5.65
Melting Point
95.43
pKa Acid
7.36
pKa Basic
0.72
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.9660
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.9513
Alpha-ketoglutarate-dependent dioxygenase FTO Q9C0B1 FTO_HUMAN Homo sapiens 3 0.9438
Enoyl-ACP reductase Q9BJJ9 Q9BJJ9_PLAFA Plasmodium falciparum 3 0.9419
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.9230
Proliferating cell nuclear antigen P12004 PCNA_HUMAN Homo sapiens 3 0.9205
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9204
Ephrin type-B receptor 4 P54760 EPHB4_HUMAN Homo sapiens 3 0.9175
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 4 0.9161
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.9151
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.9141
Tubulin alpha-1B chain P81947 TBA1B_BOVIN Bos taurus 3 0.9124
Cytohesin-2 Q99418 CYH2_HUMAN Homo sapiens 3 0.9114
Soluble acetylcholine receptor Q8WSF8 Q8WSF8_APLCA Aplysia californica 3 0.9110
Proto-oncogene tyrosine-protein kinase Src P12931 SRC_HUMAN Homo sapiens 3 0.9086
Proto-oncogene tyrosine-protein kinase Src P12931 SRC_HUMAN Homo sapiens 3 0.9083
rRNA N-glycosylase D9J2T9 D9J2T9_MOMBA Momordica balsamina 3 0.9070
Riboflavin synthase P0AFU8 RISA_ECOLI Escherichia coli 4 0.9036
Mitogen-activated protein kinase 10 P53779 MK10_HUMAN Homo sapiens 3 0.9036
Mycinamicin III 3''-O-methyltransferase Q49492 MYCF_MICGR Micromonospora griseorubida 2 0.8983
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8961
MAP kinase-activated protein kinase 2 P49137 MAPK2_HUMAN Homo sapiens 3 0.8959
Ribosomal small subunit pseudouridine synthase A P0AA43 RSUA_ECOLI Escherichia coli 3 0.8932
Gastrotropin P51161 FABP6_HUMAN Homo sapiens 3 0.8920
Lactoperoxidase A0A452E9Y6 PERL_CAPHI Capra hircus 3 0.8918
Protoporphyrinogen oxidase P50336 PPOX_HUMAN Homo sapiens 3 0.8885
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.8876
Serine/threonine-protein kinase pim-1 P11309 PIM1_HUMAN Homo sapiens 3 0.8862
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 3 0.8855
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 3 0.8850
Succinate dehydrogenase [ubiquinone] iron-sulfur subunit, mitochondrial Q33862 Q33862_ASCSU Ascaris suum 3 0.8840
Glycogen synthase Q9V2J8 Q9V2J8_PYRAB Pyrococcus abyssi 3 0.8831
Glycogen synthase Q9V2J8 Q9V2J8_PYRAB Pyrococcus abyssi 3 0.8820
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8795
2',3'-cyclic-nucleotide 3'-phosphodiesterase P16330 CN37_MOUSE Mus musculus 3 0.8779
Glycogen synthase kinase-3 beta P49841 GSK3B_HUMAN Homo sapiens 3 0.8767
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.8760
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.8746
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.8716
Epidermal growth factor receptor P00533 EGFR_HUMAN Homo sapiens 3 0.8696
Activin receptor type-1 Q04771 ACVR1_HUMAN Homo sapiens 3 0.8686
Dipeptidyl peptidase 4 P27487 DPP4_HUMAN Homo sapiens 3 0.8646
Caspase-6 P55212 CASP6_HUMAN Homo sapiens 3 0.8625
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8624
Hematopoietic prostaglandin D synthase O60760 HPGDS_HUMAN Homo sapiens 3 0.8623
Fibroblast growth factor receptor 1 P11362 FGFR1_HUMAN Homo sapiens 3 0.8606
4,4'-diapophytoene synthase A9JQL9 CRTM_STAAU Staphylococcus aureus 3 0.8605
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.8565
Phytohormone-binding protein CSBP A0A1S3THR8 PHBP_VIGRR Vigna radiata var. radiata 3 0.8564
Protoporphyrinogen oxidase P50336 PPOX_HUMAN Homo sapiens 3 0.8563
Putative ketoacyl reductase P16544 ACT3_STRCO Streptomyces coelicolor / M145) 3 0.8547
Catalase-peroxidase 2 O59651 KATG2_HALMA Haloarcula marismortui 3 0.8526
Phenylalanine-4-hydroxylase P00439 PH4H_HUMAN Homo sapiens 3 0.8516
Enoyl-ACP reductase Q9BH77 Q9BH77_PLAFA Plasmodium falciparum 3 0.8509
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.8499
Isoflavone 4'-O-methyltransferase Q29U70 I4OMT_MEDTR Medicago truncatula 4 0.8493
Bromodomain adjacent to zinc finger domain protein 2B Q9UIF8 BAZ2B_HUMAN Homo sapiens 3 0.8490
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.8439
Protein S100-A13 Q99584 S10AD_HUMAN Homo sapiens 3 0.8438
Proto-oncogene tyrosine-protein kinase receptor Ret P07949 RET_HUMAN Homo sapiens 3 0.8437
Cytochrome P450 130 P9WPN5 CP130_MYCTU Mycobacterium tuberculosis 3 0.8435
Estrogen receptor P03372 ESR1_HUMAN Homo sapiens 3 0.8351
4-diphosphocytidyl-2-C-methyl-D-erythritol kinase O67060 ISPE_AQUAE Aquifex aeolicus 3 0.8328
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.8319
Purine nucleoside phosphorylase Q8I3X4 Q8I3X4_PLAF7 Plasmodium falciparum 3 0.8283
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.8277
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8274
Tyrosine-protein kinase JAK3 P52333 JAK3_HUMAN Homo sapiens 3 0.8273
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8269
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.8263
Putative ketoacyl reductase P16544 ACT3_STRCO Streptomyces coelicolor / M145) 3 0.8252
TetR family transcriptional regulator Q58L87 Q58L87_MYCSM Mycolicibacterium smegmatis 3 0.8237
NADPH-dependent 7-cyano-7-deazaguanine reductase Q9KTK0 QUEF_VIBCH Vibrio cholerae serotype O1 3 0.8233
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.8220
Gag-Pol polyprotein P03367 POL_HV1BR Human immunodeficiency virus type 1 group M subtype B 3 0.8216
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.8203
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.8202
Tetracycline repressor protein class H P51561 TETR8_PASMD Pasteurella multocida 3 0.8198
cGMP-specific 3',5'-cyclic phosphodiesterase O76074 PDE5A_HUMAN Homo sapiens 3 0.8179
Steroid C26-monooxygenase P9WPP1 CP125_MYCTU Mycobacterium tuberculosis 3 0.8134
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 3 0.8124
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 3 0.8116
Gag-Pol polyprotein P04584 POL_HV2RO Human immunodeficiency virus type 2 subtype A 3 0.8115
Glycogen phosphorylase, muscle form P00489 PYGM_RABIT Oryctolagus cuniculus 3 0.8105
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.8099
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.8092
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 3 0.8092
Thymidine phosphorylase Q7CP66 TYPH_SALTY Salmonella typhimurium 3 0.8086
Riboflavin biosynthesis protein Q9WZW1 Q9WZW1_THEMA Thermotoga maritima 4 0.8080
EbrA repressor Q79SH7 Q79SH7_STRLI Streptomyces lividans 3 0.8073
Gag-Pol polyprotein P03367 POL_HV1BR Human immunodeficiency virus type 1 group M subtype B 3 0.8061
Probable NDP-rhamnosyltransferase Q9ALM8 Q9ALM8_SACSN Saccharopolyspora spinosa 3 0.8028
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.8012
Serine/threonine-protein kinase 24 Q9Y6E0 STK24_HUMAN Homo sapiens 3 0.7996
Matrix metalloproteinase-9 P14780 MMP9_HUMAN Homo sapiens 3 0.7985
Uracil phosphoribosyltransferase Q26998 UPP_TOXGO Toxoplasma gondii 3 0.7983
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7980
Queuine tRNA-ribosyltransferase P28720 TGT_ZYMMO Zymomonas mobilis subsp. mobilis 3 0.7979
Cytidine and deoxycytidylate deaminase zinc-binding region Q82Y41 Q82Y41_NITEU Nitrosomonas europaea 3 0.7971
Pteridine reductase 1 Q01782 PTR1_LEIMA Leishmania major 3 0.7946
Aklavinone 12-hydroxylase RdmE Q54530 DNRF_STREF Streptomyces purpurascens 4 0.7942
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7936
Purine nucleoside phosphorylase P00491 PNPH_HUMAN Homo sapiens 3 0.7931
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 3 0.7925
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7923
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7918
Methionine aminopeptidase P0AE18 MAP1_ECOLI Escherichia coli 3 0.7914
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7913
Mitogen-activated protein kinase 1 P28482 MK01_HUMAN Homo sapiens 3 0.7904
Dipeptidyl peptidase 4 P27487 DPP4_HUMAN Homo sapiens 3 0.7898
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7892
Carbonyl reductase [NADPH] 1 P16152 CBR1_HUMAN Homo sapiens 3 0.7888
Fatty acid-binding protein, intestinal P12104 FABPI_HUMAN Homo sapiens 3 0.7861
Pyridoxal kinase P82197 PDXK_SHEEP Ovis aries 3 0.7826
Dipeptidyl peptidase 4 P22411 DPP4_PIG Sus scrofa 3 0.7810
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7794
Nitric oxide synthase, inducible P29477 NOS2_MOUSE Mus musculus 3 0.7772
Tyrosine-protein kinase SYK P43405 KSYK_HUMAN Homo sapiens 3 0.7762
DNA ligase P43813 DNLJ_HAEIN Haemophilus influenzae 4 0.7747
HTH-type transcriptional repressor PurR P0ACP7 PURR_ECOLI Escherichia coli 3 0.7746
Purine nucleoside phosphorylase DeoD-type P0ABP9 DEOD_ECO57 Escherichia coli O157:H7 3 0.7743
cGMP-dependent protein kinase, putative A5K0N4 A5K0N4_PLAVS Plasmodium vivax 3 0.7733
Homoserine dehydrogenase P31116 DHOM_YEAST Saccharomyces cerevisiae 3 0.7729
Hypoxanthine phosphoribosyltransferase Q4DRC4 Q4DRC4_TRYCC Trypanosoma cruzi 3 0.7729
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7727
Gag-Pol polyprotein P04584 POL_HV2RO Human immunodeficiency virus type 2 subtype A 3 0.7721
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.7699
Ribonuclease J H9CZL7 H9CZL7_DEIRD Deinococcus radiodurans 3 0.7688
2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase Q3JRA0 ISPF_BURP1 Burkholderia pseudomallei 3 0.7680
Purine nucleoside phosphorylase DeoD-type Q5EEL8 DEOD_BACCE Bacillus cereus 3 0.7677
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 3 0.7675
Casein kinase I isoform gamma-3 Q9Y6M4 KC1G3_HUMAN Homo sapiens 3 0.7667
F420-dependent NADP reductase O29370 FNO_ARCFU Archaeoglobus fulgidus 3 0.7658
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7653
Purine nucleoside phosphorylase DeoD-type P0ABP8 DEOD_ECOLI Escherichia coli 3 0.7616
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 3 0.7612
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.7606
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.7585
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7582
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7577
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7565
Prostaglandin G/H synthase 1 P05979 PGH1_SHEEP Ovis aries 3 0.7559
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 4 0.7550
HTH-type transcriptional regulator QacR P0A0N4 QACR_STAAU Staphylococcus aureus 3 0.7549
Transthyretin P02766 TTHY_HUMAN Homo sapiens 3 0.7547
Aminoglycoside 3'-phosphotransferase AphA1-IAB B0VD92 B0VD92_ACIBY Acinetobacter baumannii 3 0.7527
Mitogen-activated protein kinase 8 P45983 MK08_HUMAN Homo sapiens 3 0.7523
Flavin-dependent thymidylate synthase Q9WYT0 THYX_THEMA Thermotoga maritima 3 0.7509
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7505
Cytohesin-2 Q99418 CYH2_HUMAN Homo sapiens 3 0.7498
Cathepsin S P25774 CATS_HUMAN Homo sapiens 3 0.7496
Thymidylate synthase P0A886 TYSY_ECO57 Escherichia coli O157:H7 3 0.7495
Albumin P02768 ALBU_HUMAN Homo sapiens 3 0.7493
Cytosolic purine 5'-nucleotidase P49902 5NTC_HUMAN Homo sapiens 2 0.7493
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.7490
Histamine N-methyltransferase P50135 HNMT_HUMAN Homo sapiens 3 0.7489
Tubulin alpha chain A0A0R4I993 A0A0R4I993_SUSBA Sus barbatus 3 0.7485
Peptidyl-prolyl cis-trans isomerase FKBP5 Q13451 FKBP5_HUMAN Homo sapiens 3 0.7484
Dihydrofolate reductase P00374 DYR_HUMAN Homo sapiens 3 0.7469
Angiotensin-converting enzyme 2 Q9BYF1 ACE2_HUMAN Homo sapiens 2 0.7466
Acetyl-CoA carboxylase Q00955 ACAC_YEAST Saccharomyces cerevisiae 3 0.7459
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7449
Dihydroorotate dehydrogenase (quinone), mitochondrial Q08210 PYRD_PLAF7 Plasmodium falciparum 3 0.7449
Mitogen-activated protein kinase 1 P28482 MK01_HUMAN Homo sapiens 4 0.7445
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7444
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7443
Flavoredoxin Q72HI0 Q72HI0_THET2 Thermus thermophilus 3 0.7440
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7439
Catechol O-methyltransferase P22734 COMT_RAT Rattus norvegicus 3 0.7435
Flavin-dependent monooxygenase Q93L51 TETX_BACT4 Bacteroides thetaiotaomicron 3 0.7424
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7414
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7413
cAMP-dependent protein kinase catalytic subunit alpha P00517 KAPCA_BOVIN Bos taurus 3 0.7409
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 4 0.7407
Ephrin type-A receptor 3 P29320 EPHA3_HUMAN Homo sapiens 3 0.7407
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7406
HTH-type transcriptional regulator QacR P0A0N4 QACR_STAAU Staphylococcus aureus 2 0.7403
Enoyl-ACP reductase Q9BJJ9 Q9BJJ9_PLAFA Plasmodium falciparum 4 0.7396
Angiopoietin-1 receptor Q02763 TIE2_HUMAN Homo sapiens 3 0.7390
Serine/threonine-protein kinase N1 Q16512 PKN1_HUMAN Homo sapiens 3 0.7389
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7379
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7378
2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase P62617 ISPF_ECOLI Escherichia coli 3 0.7378
Tyrosine-protein kinase JAK3 P52333 JAK3_HUMAN Homo sapiens 3 0.7377
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7372
4-hydroxyphenylacetate 3-monooxygenase Q8YHT7 Q8YHT7_BRUME Brucella melitensis biotype 1 2 0.7371
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 3 0.7368
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7359
Pentalenic acid synthase Q825I8 CYP28_STRAW Streptomyces avermitilis 2 0.7351
Aspartokinase 1, chloroplastic Q9LYU8 AK1_ARATH Arabidopsis thaliana 3 0.7350
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 3 0.7345
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7337
Tyrosine-protein kinase Lck P06239 LCK_HUMAN Homo sapiens 3 0.7333
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7332
Purine nucleoside phosphorylase DeoD-type O34925 DEOD_BACSU Bacillus subtilis 3 0.7332
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7330
Lactotransferrin P24627 TRFL_BOVIN Bos taurus 2 0.7330
Cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase Q46381 BPHB_COMTE Comamonas testosteroni 3 0.7313
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7312
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7311
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7310
Dual specificity mitogen-activated protein kinase kinase 1 Q02750 MP2K1_HUMAN Homo sapiens 3 0.7306
Ketimine reductase mu-crystallin O54983 CRYM_MOUSE Mus musculus 2 0.7301
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7301
Tubulin alpha-1B chain P81947 TBA1B_BOVIN Bos taurus 3 0.7297
Tubulin alpha chain D0VWZ0 D0VWZ0_SHEEP Ovis aries 3 0.7292
Oxygen-insensitive NAD(P)H nitroreductase P38489 NFSB_ECOLI Escherichia coli 3 0.7291
Raucaffricine-O-beta-D-glucosidase Q9SPP9 RG1_RAUSE Rauvolfia serpentina 3 0.7290
Fatty acid-binding protein, adipocyte P15090 FABP4_HUMAN Homo sapiens 2 0.7290
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 3 0.7287
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7287
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 4 0.7283
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7272
ATP-dependent protease subunit HslV P0A7B8 HSLV_ECOLI Escherichia coli 3 0.7266
Dihydrofolate reductase P16184 DYR_PNECA Pneumocystis carinii 3 0.7262
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7245
Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic Q43088 RBCMT_PEA Pisum sativum 3 0.7241
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7236
Dihydrofolate reductase P00378 DYR_CHICK Gallus gallus 2 0.7234
Glycylpeptide N-tetradecanoyltransferase Q4Q5S8 Q4Q5S8_LEIMA Leishmania major 2 0.7232
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7229
Tannase B3Y018 B3Y018_LACPN Lactiplantibacillus plantarum 3 0.7227
Dihydrofolate reductase Q81R22 Q81R22_BACAN Bacillus anthracis 3 0.7224
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7224
Carbonic anhydrase 12 O43570 CAH12_HUMAN Homo sapiens 2 0.7222
ActVA 6 protein Q53908 Q53908_STRCH Streptomyces coelicolor 3 0.7221
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.7221
Polymerase acidic protein C3W5S0 C3W5S0_I09A0 Influenza A virus 2 0.7219
Tyrosine-protein kinase JAK1 P23458 JAK1_HUMAN Homo sapiens 3 0.7209
NmrA-like family domain-containing protein 1 Q9HBL8 NMRL1_HUMAN Homo sapiens 2 0.7208
Cytochrome P450 2C8 P10632 CP2C8_HUMAN Homo sapiens 3 0.7206
APH(2'')-Id O68183 O68183_ENTCA Enterococcus casseliflavus 3 0.7206
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7206
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7205
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7205
Vitamin D3 dihydroxylase P18326 CPXE_STRGO Streptomyces griseolus 3 0.7205
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7198
UDP-galactopyranose mutase Q48485 GLF1_KLEPN Klebsiella pneumoniae 3 0.7193
Tyrosine-protein kinase JAK2 O60674 JAK2_HUMAN Homo sapiens 3 0.7193
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform P48736 PK3CG_HUMAN Homo sapiens 3 0.7187
HTH-type transcriptional regulator QacR P0A0N4 QACR_STAAU Staphylococcus aureus 4 0.7186
Dihydrofolate reductase P22906 DYR_CANAX Candida albicans 3 0.7185
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7173
Albumin P02768 ALBU_HUMAN Homo sapiens 3 0.7171
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7170
Plasma membrane ATPase Q42932 Q42932_NICPL Nicotiana plumbaginifolia 2 0.7170
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7169
A disintegrin and metalloproteinase with thrombospondin motifs 5 Q9UNA0 ATS5_HUMAN Homo sapiens 3 0.7167
Transthyretin P02767 TTHY_RAT Rattus norvegicus 2 0.7166
Death-associated protein kinase 1 P53355 DAPK1_HUMAN Homo sapiens 3 0.7164
NAD(P) transhydrogenase subunit alpha part 1 Q2RSB2 PNTAA_RHORT Rhodospirillum rubrum 3 0.7163
CCA-adding enzyme O28126 CCA_ARCFU Archaeoglobus fulgidus 2 0.7163
Beta-galactoside-specific lectin 4 Q6ITZ3 ML4_VISAL Viscum album 2 0.7162
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 3 0.7160
Phenazine biosynthesis protein A/B Q396C9 Q396C9_BURL3 Burkholderia lata 2 0.7155
Dihydrofolate reductase P0A017 DYR_STAAU Staphylococcus aureus 3 0.7153
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 2 0.7152
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.7149
Nucleoprotein P33469 NCAP_CVHOC Human coronavirus OC43 3 0.7147
Sterol 14alpha-demethylase P9WPP9 CP51_MYCTU Mycobacterium tuberculosis 3 0.7144
Estrogen receptor beta Q92731 ESR2_HUMAN Homo sapiens 3 0.7142
Dihydrofolate reductase P16184 DYR_PNECA Pneumocystis carinii 3 0.7142
Mycocyclosin synthase P9WPP7 CP121_MYCTU Mycobacterium tuberculosis 2 0.7133
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 3 0.7130
Streptogramin A acetyltransferase P50870 VATD_ENTFC Enterococcus faecium 2 0.7129
Activin receptor type-1 Q04771 ACVR1_HUMAN Homo sapiens 3 0.7128
Urokinase-type plasminogen activator P00749 UROK_HUMAN Homo sapiens 2 0.7119
Uncharacterized protein Q3F0V8 Q3F0V8_BACTI Bacillus thuringiensis serovar israelensis ATCC 35646 3 0.7115
cGMP-dependent protein kinase 1 P00516 KGP1_BOVIN Bos taurus 3 0.7114
Hexokinase-4 P35557 HXK4_HUMAN Homo sapiens 3 0.7113
Dihydrofolate reductase Q81R22 Q81R22_BACAN Bacillus anthracis 3 0.7111
Dihydrofolate reductase type 1 from Tn4003 P13955 DYRA_STAAU Staphylococcus aureus 3 0.7098
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7098
Fibroblast growth factor receptor 1 P11362 FGFR1_HUMAN Homo sapiens 3 0.7095
Dihydrofolate reductase O30463 O30463_MYCAV Mycobacterium avium 3 0.7091
Putative cytochrome P450 Q70AS3 Q70AS3_STRPE Streptomyces peucetius 3 0.7090
Gag-Pol polyprotein P05896 POL_SIVM1 Simian immunodeficiency virus 3 0.7078
Mitogen-activated protein kinase 14 Q16539 MK14_HUMAN Homo sapiens 4 0.7077
Endoplasmin P14625 ENPL_HUMAN Homo sapiens 3 0.7074
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.7073
Dihydrofolate reductase P0A017 DYR_STAAU Staphylococcus aureus 3 0.7069
dTDP-4-dehydrorhamnose 3,5-epimerase A0A6L7H6N0 A0A1S0QLH9_BACAN Bacillus anthracis 3 0.7069
Calmodulin-domain protein kinase 1, putative A3FQ16 A3FQ16_CRYPI Cryptosporidium parvum 3 0.7067
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7061
Biotin carboxylase P24182 ACCC_ECOLI Escherichia coli 4 0.7057
Soluble acetylcholine receptor Q8WSF8 Q8WSF8_APLCA Aplysia californica 2 0.7056
Transthyretin P02767 TTHY_RAT Rattus norvegicus 2 0.7055
NmrA-like family domain-containing protein 1 Q9HBL8 NMRL1_HUMAN Homo sapiens 2 0.7054
Oxygen-insensitive NAD(P)H nitroreductase P38489 NFSB_ECOLI Escherichia coli 3 0.7049
Catechol O-methyltransferase P22734 COMT_RAT Rattus norvegicus 3 0.7047
Hematopoietic prostaglandin D synthase O60760 HPGDS_HUMAN Homo sapiens 2 0.7042
Basic phospholipase A2 VRV-PL-VIIIa P59071 PA2B8_DABRR Daboia russelii 2 0.7041
Alpha-ketoglutarate-dependent dioxygenase FTO Q9C0B1 FTO_HUMAN Homo sapiens 2 0.7038
Histone-lysine N-methyltransferase EHMT2 Q96KQ7 EHMT2_HUMAN Homo sapiens 3 0.7036
Tryptophan synthase alpha chain P00929 TRPA_SALTY Salmonella typhimurium 3 0.7036
Ferrochelatase, mitochondrial P22830 HEMH_HUMAN Homo sapiens 3 0.7031
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.7030
Diamine acetyltransferase 1 P21673 SAT1_HUMAN Homo sapiens 2 0.7025
Dodecin Q5SIE3 DODEC_THET8 Thermus thermophilus 4 0.7021
Thymidylate synthase P0A884 TYSY_ECOLI Escherichia coli 3 0.7021
Histone-lysine N-methyltransferase SETD7 Q8WTS6 SETD7_HUMAN Homo sapiens 3 0.7021
Dihydrofolate reductase P00374 DYR_HUMAN Homo sapiens 3 0.7016
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7014
NAD(P)H dehydrogenase [quinone] 1 P15559 NQO1_HUMAN Homo sapiens 3 0.7011
Histamine N-methyltransferase P50135 HNMT_HUMAN Homo sapiens 2 0.7011
Gag-Pol polyprotein P12497 POL_HV1N5 Human immunodeficiency virus type 1 group M subtype B 2 0.7005
Peroxisome proliferator-activated receptor gamma P37231 PPARG_HUMAN Homo sapiens 2 0.7004
Endoplasmin P41148 ENPL_CANLF Canis lupus familiaris 3 0.7002

Download SDF