Sigma-(E)-deoxy-amplexichromanol - Compound Card

Sigma-(E)-deoxy-amplexichromanol

Select a section from the left sidebar

Sigma-(E)-deoxy-amplexichromanol

Structure
Zoomed Structure
  • Family: Plantae - Pinaceae
  • Kingdom: Plantae
  • Class: Phenolic
    • Subclass: Tocotrienolic Acid Derivative
Canonical Smiles OC/C(=C/CC/C(=C/CC/C(=C/CC[C@]1(C)CCc2c(O1)c(C)cc(c2)O)/C)/C)/C
InChI InChI=1S/C27H40O3/c1-20(11-7-12-22(3)19-28)9-6-10-21(2)13-8-15-27(5)16-14-24-18-25(29)17-23(4)26(24)30-27/h9,12-13,17-18,28-29H,6-8,10-11,14-16,19H2,1-5H3/b20-9+,21-13+,22-12+/t27-/m1/s1
InChIKey CAGBDTBNTAQAEH-IBWALAQESA-N
Formula C27H40O3
HBA 3
HBD 2
MW 412.61
Rotatable Bonds 10
TPSA 49.69
LogP 6.96
Number Rings 2
Number Aromatic Rings 1
Heavy Atom Count 30
Formal Charge 0
Fraction CSP3 0.56
Exact Mass 412.3
Number of Lipinski Rule Violations 1
# Species Family Kingdom NCBI Taxonomy ID
1 Cedrus atlantica Pinaceae Plantae 123597

Showing of synonyms

  • Maya B, Abedini A, et al. (2017). A new δ-tocotrienolic acid derivative and other constituents from the cones of Cedrus atlantica and their in vitro antimicrobial activity. Phytochemistry Letters, 2017, 20, 252-258. [View]
Pubchem: 171363567

No compound-protein relationship available.

Structure

SMILES: C1CCOc(c12)cccc2

Level: 0

Mol. Weight: 412.61 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-4.97
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-4.43
Human Oral Bioavailability 50%
Non-Bioavailable
P-Glycoprotein Inhibitor
Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-3.39

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Penetrable
Fraction Unbound (Human)
1.27
Plasma Protein Binding
81.46
Steady State Volume of Distribution
-

Metabolism

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

Excretion

Clearance
0.68
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Toxic
Bioconcentration Factor
1.52
Biodegradation
Safe
Carcinogenesis
Toxic
Crustacean
Toxic
Liver Injury I (DILI)
Safe
Eye Corrosion
Safe
Eye Irritation
Safe
Maximum Tolerated Dose
-1.3
Liver Injury II
Safe
hERG Blockers
Safe
Daphnia Maga
6.3
Micronucleos
Safe
NR-AhR
Safe
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
-14.04
Rat (Acute)
1.73
Rat (Chronic Oral)
1.92
Fathead Minnow
5.96
Respiratory Disease
Toxic
Skin Sensitisation
Toxic
SR-ARE
Toxic
SR-ATAD5
Safe
SR-HSE
Toxic
SR-MMP
Safe
SR-p53
Safe

General Properties

Boiling Point
454.0
Hydration Free Energy
-5.48
Log(D) at pH=7.4
4.92
Log(P)
7.16
Log S
-5.9
Log(Vapor Pressure)
-7.89
Melting Point
78.98
pKa Acid
11.72
pKa Basic
6.83
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
Epoxide hydrolase Q41415 Q41415_SOLTU Solanum tuberosum 3 0.9535
Cyclin-dependent kinase 2 P24941 CDK2_HUMAN Homo sapiens 3 0.9295
Caspase-7 P55210 CASP7_HUMAN Homo sapiens 3 0.9284
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.9276
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.9270
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.9248
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 3 0.9242
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.9207
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 3 0.9186
Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 P04191 AT2A1_RABIT Oryctolagus cuniculus 3 0.9157
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.9144
Casein kinase II subunit alpha P28523 CSK2A_MAIZE Zea mays 3 0.9116
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.9097
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 3 0.9093
Estrogen receptor P03372 ESR1_HUMAN Homo sapiens 3 0.9078
3-alpha-hydroxysteroid dehydrogenase P23457 DIDH_RAT Rattus norvegicus 3 0.9062
Alcohol dehydrogenase E chain P00327 ADH1E_HORSE Equus caballus 4 0.9021
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8981
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 3 0.8948
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.8913
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8898
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 3 0.8893
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 3 0.8867
Mycinamicin III 3''-O-methyltransferase Q49492 MYCF_MICGR Micromonospora griseorubida 2 0.8857
Bacteriorhodopsin P02945 BACR_HALSA Halobacterium salinarum 3 0.8829
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 3 0.8822
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.8813
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 3 0.8809
Uncharacterized protein YML079W Q03629 YMH9_YEAST Saccharomyces cerevisiae 3 0.8809
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 3 0.8799
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8793
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 3 0.8774
Ferrochelatase, mitochondrial P22830 HEMH_HUMAN Homo sapiens 3 0.8773
Beta-lactoglobulin P02754 LACB_BOVIN Bos taurus 3 0.8765
17-beta-hydroxysteroid dehydrogenase 14 Q9BPX1 DHB14_HUMAN Homo sapiens 3 0.8764
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase F6MZ55 F6MZ55_9FIRM Sporomusa ovata 3 0.8728
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8651
Vitamin D(3) 25-hydroxylase C4B644 CPVDH_PSEAH Pseudonocardia autotrophica 3 0.8647
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 3 0.8645
Mycinamicin III 3''-O-methyltransferase Q49492 MYCF_MICGR Micromonospora griseorubida 2 0.8612
Thiamine-phosphate synthase P39594 THIE_BACSU Bacillus subtilis 3 0.8600
Albumin P02768 ALBU_HUMAN Homo sapiens 3 0.8594
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8583
Albumin P02769 ALBU_BOVIN Bos taurus 3 0.8580
11-beta-hydroxysteroid dehydrogenase 1 P50172 DHI1_MOUSE Mus musculus 3 0.8572
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase Q9TQS6 DHDH_MACFA Macaca fascicularis 3 0.8560
Sulfotransferase 2A1 Q06520 ST2A1_HUMAN Homo sapiens 3 0.8556
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 3 0.8549
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8539
Na(+):neurotransmitter symporter (Snf family) O67854 O67854_AQUAE Aquifex aeolicus 3 0.8513
Retinol-binding protein 1 P02696 RET1_RAT Rattus norvegicus 3 0.8509
Corticosteroid-binding globulin P08185 CBG_HUMAN Homo sapiens 3 0.8505
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.8458
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 4 0.8453
Gag-Pol polyprotein P04585 POL_HV1H2 Human immunodeficiency virus type 1 group M subtype B 4 0.8444
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8438
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Q9Y233 PDE10_HUMAN Homo sapiens 3 0.8433
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 3 0.8429
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase F6MZ55 F6MZ55_9FIRM Sporomusa ovata 3 0.8399
Retinol dehydratase Q26490 Q26490_SPOFR Spodoptera frugiperda 3 0.8366
Neocarzinostatin P0A3R9 NCZS_STRCZ Streptomyces carzinostaticus 3 0.8333
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.8331
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 3 0.8317
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 3 0.8317
Steroid 21-hydroxylase P08686 CP21A_HUMAN Homo sapiens 3 0.8305
Soluble acetylcholine receptor Q8WSF8 Q8WSF8_APLCA Aplysia californica 3 0.8303
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 3 0.8297
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.8279
Alcohol dehydrogenase E chain P00327 ADH1E_HORSE Equus caballus 3 0.8269
Probable NDP-rhamnosyltransferase Q9ALM8 Q9ALM8_SACSN Saccharopolyspora spinosa 3 0.8264
Aldo-keto reductase family 1 member C1 Q04828 AK1C1_HUMAN Homo sapiens 3 0.8220
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.8202
Rhodopsin P02699 OPSD_BOVIN Bos taurus 3 0.8169
Pteridine reductase, putative Q581W1 Q581W1_TRYB2 Trypanosoma brucei brucei 3 0.8168
Chitinase Q54276 Q54276_SERMA Serratia marcescens 3 0.8165
Alcohol dehydrogenase E chain P00327 ADH1E_HORSE Equus caballus 3 0.8144
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 3 0.8138
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 3 0.8136
Enoyl-[acyl-carrier-protein] reductase [NADH] P9WGR1 INHA_MYCTU Mycobacterium tuberculosis 3 0.8101
Nuclear receptor subfamily 1 group I member 3 O35627 NR1I3_MOUSE Mus musculus 3 0.8083
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.8054
Polyprotein Q80J95 Q80J95_9CALI Murine norovirus 1 3 0.8034
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.8026
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 3 0.8025
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 3 0.8011
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.7987
Integrin alpha-L P20701 ITAL_HUMAN Homo sapiens 3 0.7978
Methylketone synthase I E0YCS2 E0YCS2_SOLHA Solanum habrochaites 3 0.7973
Cellular retinol-binding protein type II Q8UVG6 Q8UVG6_DANRE Danio rerio 3 0.7967
Beta-lactoglobulin P02754 LACB_BOVIN Bos taurus 3 0.7949
Steroid C26-monooxygenase P9WPP1 CP125_MYCTU Mycobacterium tuberculosis 3 0.7934
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 3 0.7931
Lactoylglutathione lyase Q9CPU0 LGUL_MOUSE Mus musculus 2 0.7894
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 3 0.7891
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 3 0.7880
Bifunctional epoxide hydrolase 2 P34913 HYES_HUMAN Homo sapiens 3 0.7865
ADP-ribosylation factor 1 P84080 ARF1_BOVIN Bos taurus 3 0.7864
Sulfotransferase 2A1 Q06520 ST2A1_HUMAN Homo sapiens 3 0.7857
Beta-elicitin cryptogein P15570 ELIB_PHYCR Phytophthora cryptogea 3 0.7855
Gag-Pol polyprotein P04585 POL_HV1H2 Human immunodeficiency virus type 1 group M subtype B 3 0.7841
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 3 0.7839
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 3 0.7826
High affinity 3',5'-cyclic-AMP phosphodiesterase 7A Q13946 PDE7A_HUMAN Homo sapiens 3 0.7801
Methylketone synthase I E0YCS2 E0YCS2_SOLHA Solanum habrochaites 3 0.7801
Nitric oxide synthase 1 P29476 NOS1_RAT Rattus norvegicus 3 0.7796
Cytochrome b6 P83791 CYB6_MASLA Mastigocladus laminosus 3 0.7778
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 3 0.7773
Retinol-binding protein 2 P50120 RET2_HUMAN Homo sapiens 3 0.7762
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.7757
UDP-glycosyltransferase 72B1 Q9M156 U72B1_ARATH Arabidopsis thaliana 3 0.7752
Mycinamicin III 3''-O-methyltransferase Q49492 MYCF_MICGR Micromonospora griseorubida 3 0.7715
Glutamate receptor 2 P19491 GRIA2_RAT Rattus norvegicus 3 0.7714
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 3 0.7711
Camphor 5-monooxygenase P00183 CPXA_PSEPU Pseudomonas putida 3 0.7686
Peroxisome proliferator-activated receptor alpha Q07869 PPARA_HUMAN Homo sapiens 3 0.7685
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 3 0.7672
Bromodomain adjacent to zinc finger domain protein 2B Q9UIF8 BAZ2B_HUMAN Homo sapiens 2 0.7670
ADP-ribosylation factor 1 P84077 ARF1_HUMAN Homo sapiens 2 0.7669
Enoyl-[acyl-carrier-protein] reductase [NADH] P9WGR0 INHA_MYCTO Mycobacterium tuberculosis 3 0.7664
Japanin M1MR49 M1MR49_RHIAP Rhipicephalus appendiculatus 4 0.7662
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7657
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 3 0.7656
ATP-dependent molecular chaperone HSP82 P02829 HSP82_YEAST Saccharomyces cerevisiae 3 0.7648
Serine/threonine-protein kinase Chk2 O96017 CHK2_HUMAN Homo sapiens 3 0.7639
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7638
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 3 0.7632
Gag-Pol polyprotein P04585 POL_HV1H2 Human immunodeficiency virus type 1 group M subtype B 5 0.7631
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 3 0.7629
Serine/threonine-protein kinase Chk1 O14757 CHK1_HUMAN Homo sapiens 3 0.7623
AGAP003309-PA A0A1U7F4W2 A0A1U7F4W2_ANOGA Anopheles gambiae 3 0.7594
Chloramphenicol acetyltransferase P62577 CAT_ECOLX Escherichia coli 4 0.7581
Bifunctional dihydrofolate reductase-thymidylate synthase P13922 DRTS_PLAFK Plasmodium falciparum 2 0.7575
Abscisic acid receptor PYR1 O49686 PYR1_ARATH Arabidopsis thaliana 3 0.7559
Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 P04191 AT2A1_RABIT Oryctolagus cuniculus 3 0.7553
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 4 0.7522
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7515
Sex hormone-binding globulin P04278 SHBG_HUMAN Homo sapiens 3 0.7513
Sodium-dependent dopamine transporter Q7K4Y6 DAT_DROME Drosophila melanogaster 2 0.7508
glutaryl-CoA dehydrogenase (ETF) Q3JP94 Q3JP94_BURP1 Burkholderia pseudomallei 2 0.7508
Eugenol synthase 1 Q15GI4 EGS1_OCIBA Ocimum basilicum 3 0.7507
Hemolymph juvenile hormone binding protein Q9U556 Q9U556_BOMMO Bombyx mori 3 0.7501
Jasmonoyl--L-amino acid synthetase JAR1 Q9SKE2 JAR1_ARATH Arabidopsis thaliana 3 0.7488
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7483
Pteridine reductase, putative Q581W1 Q581W1_TRYB2 Trypanosoma brucei brucei 3 0.7474
Retinol-binding protein 1 P09455 RET1_HUMAN Homo sapiens 3 0.7471
Aromatase P11511 CP19A_HUMAN Homo sapiens 3 0.7471
Glutathione S-transferase A1 P08263 GSTA1_HUMAN Homo sapiens 2 0.7470
Carminomycin 4-O-methyltransferase DnrK Q06528 DNRK_STRPE Streptomyces peucetius 2 0.7462
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7447
Peptidyl-prolyl cis-trans isomerase FKBP1A P62942 FKB1A_HUMAN Homo sapiens 2 0.7444
Mycinamicin III 3''-O-methyltransferase Q49492 MYCF_MICGR Micromonospora griseorubida 3 0.7440
Cartilage oligomeric matrix protein P35444 COMP_RAT Rattus norvegicus 3 0.7440
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 3 0.7438
Endothiapepsin P11838 CARP_CRYPA Cryphonectria parasitica 2 0.7437
Aldo-keto reductase family 1 member C3 P42330 AK1C3_HUMAN Homo sapiens 2 0.7431
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.7430
Abscisic acid receptor PYL9 Q5Z8S0 PYL9_ORYSJ Oryza sativa subsp. japonica 4 0.7429
Casein kinase II subunit alpha P68400 CSK21_HUMAN Homo sapiens 2 0.7428
Putative cytochrome P450 120 Q59990 CP120_SYNY3 Synechocystis sp 3 0.7416
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7401
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 3 0.7400
Ferrochelatase, mitochondrial P22830 HEMH_HUMAN Homo sapiens 3 0.7396
Cholesterol side-chain cleavage enzyme, mitochondrial P05108 CP11A_HUMAN Homo sapiens 3 0.7390
Carbonic anhydrase 2 P00918 CAH2_HUMAN Homo sapiens 2 0.7385
cAMP-dependent protein kinase catalytic subunit alpha P17612 KAPCA_HUMAN Homo sapiens 3 0.7383
Chorismate mutase AroH P19080 AROH_BACSU Bacillus subtilis 2 0.7374
Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha Q04631 FNTA_RAT Rattus norvegicus 3 0.7373
Beta-secretase 1 P56817 BACE1_HUMAN Homo sapiens 2 0.7367
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 2 0.7366
3',5'-cyclic-AMP phosphodiesterase 4A P27815 PDE4A_HUMAN Homo sapiens 3 0.7359
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial Q15119 PDK2_HUMAN Homo sapiens 3 0.7354
Fructose-1,6-bisphosphatase 1 P00636 F16P1_PIG Sus scrofa 3 0.7348
ADP-ribosylation factor 1 P84080 ARF1_BOVIN Bos taurus 2 0.7347
Vitamin D3 receptor P13053 VDR_RAT Rattus norvegicus 3 0.7344
Pteridine reductase O76290 O76290_TRYBB Trypanosoma brucei brucei 2 0.7341
Mitochondrial poly(A) polymerase F1NBW0 F1NBW0_CHICK Gallus gallus 2 0.7338
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 3 0.7333
Beta-1 adrenergic receptor P07700 ADRB1_MELGA Meleagris gallopavo 3 0.7330
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 3 0.7326
Enoyl-[acyl-carrier-protein] reductase [NADH] P9WGR1 INHA_MYCTU Mycobacterium tuberculosis 3 0.7322
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7295
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 3 0.7290
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 3 0.7286
2,7-dihydroxy-5-methyl-1-naphthoate 7-O-methyltransferase Q84HC8 NCSB1_STRCZ Streptomyces carzinostaticus 2 0.7285
Biotin carboxylase P24182 ACCC_ECOLI Escherichia coli 3 0.7285
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 3 0.7279
Muconolactone Delta-isomerase Q8G9L0 Q8G9L0_RHOOP Rhodococcus opacus 2 0.7278
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 3 0.7275
3-phosphoinositide-dependent protein kinase 1 O15530 PDPK1_HUMAN Homo sapiens 3 0.7272
Vitamin D-binding protein P02774 VTDB_HUMAN Homo sapiens 2 0.7272
Retinol-binding protein 2 P50120 RET2_HUMAN Homo sapiens 3 0.7260
Kynurenine 3-monooxygenase P38169 KMO_YEAST Saccharomyces cerevisiae 2 0.7258
Gastrotropin P51161 FABP6_HUMAN Homo sapiens 3 0.7256
Catechol 2,3-dioxygenase Q6REQ5 Q6REQ5_9NOCA Rhodococcus sp. DK17 3 0.7253
Multidrug transporter MdfA P0AEY8 MDFA_ECOLI Escherichia coli 3 0.7253
Genome polyprotein P26663 POLG_HCVBK Hepatitis C virus genotype 1b 3 0.7251
cGMP-specific 3',5'-cyclic phosphodiesterase O76074 PDE5A_HUMAN Homo sapiens 3 0.7249
Vitamin D3 receptor P13053 VDR_RAT Rattus norvegicus 3 0.7247
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 4 0.7246
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 3 0.7245
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 3 0.7242
Glutathione S-transferase P P09211 GSTP1_HUMAN Homo sapiens 2 0.7237
Type IV / VI secretion system DotU domain-containing protein Q9KN50 Q9KN50_VIBCH Vibrio cholerae serotype O1 2 0.7234
Sulfide-quinone reductase B7JBP8 SQRD_ACIF2 Acidithiobacillus ferrooxidans) 3 0.7231
Trichodiene synthase P13513 TRI5_FUSSP Fusarium sporotrichioides 2 0.7218
Gag-Pol polyprotein P04585 POL_HV1H2 Human immunodeficiency virus type 1 group M subtype B 3 0.7211
Sulfide-quinone reductase B7JBP8 SQRD_ACIF2 Acidithiobacillus ferrooxidans) 3 0.7206
Retinol-binding protein 2 P50120 RET2_HUMAN Homo sapiens 3 0.7203
Lanosterol synthase P48449 ERG7_HUMAN Homo sapiens 3 0.7186
Pyridoxal kinase P82197 PDXK_SHEEP Ovis aries 3 0.7184
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 3 0.7181
Aryl hydrocarbon receptor nuclear translocator P53762 ARNT_MOUSE Mus musculus 3 0.7177
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7176
Vitamin D3 receptor P13053 VDR_RAT Rattus norvegicus 3 0.7171
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7168
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 3 0.7151
Vitamin D3 dihydroxylase P18326 CPXE_STRGO Streptomyces griseolus 3 0.7145
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 4 0.7138
Histone deacetylase 8 Q9BY41 HDAC8_HUMAN Homo sapiens 2 0.7126
Ferrochelatase, mitochondrial P22830 HEMH_HUMAN Homo sapiens 3 0.7118
Abscisic acid receptor PYR1 O49686 PYR1_ARATH Arabidopsis thaliana 3 0.7115
Thymidine kinase P0DTH5 KITH_HHV11 Human herpesvirus 1 2 0.7115
Cholesterol side-chain cleavage enzyme, mitochondrial P00189 CP11A_BOVIN Bos taurus 3 0.7113
Avidin P02701 AVID_CHICK Gallus gallus 2 0.7108
11-beta-hydroxysteroid dehydrogenase 1 P28845 DHI1_HUMAN Homo sapiens 2 0.7102
Genome polyprotein O92972 POLG_HCVJ4 Hepatitis C virus genotype 1b 2 0.7101
Protein BRASSINOSTEROID INSENSITIVE 1 O22476 BRI1_ARATH Arabidopsis thaliana 3 0.7096
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial Q0QF01 SDHA_PIG Sus scrofa 2 0.7095
Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 P04191 AT2A1_RABIT Oryctolagus cuniculus 3 0.7090
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7089
Soluble acetylcholine receptor Q8WSF8 Q8WSF8_APLCA Aplysia californica 2 0.7089
Deacetoxycephalosporin C synthase P18548 CEFE_STRCL Streptomyces clavuligerus 2 0.7079
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 2 0.7075
3-hydroxyanthranilate 3,4-dioxygenase Q1LCS4 3HAO_CUPMC Cupriavidus metallidurans 2 0.7066
Sulfide-quinone reductase B7JBP8 SQRD_ACIF2 Acidithiobacillus ferrooxidans) 3 0.7061
3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase P19992 HSD_STREX Streptomyces exfoliatus 2 0.7057
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 3 0.7053
Gibberellin receptor GID1A Q9MAA7 GID1A_ARATH Arabidopsis thaliana 3 0.7052
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 3 0.7052
Glucocorticoid receptor P04150 GCR_HUMAN Homo sapiens 3 0.7050
Lanosterol 14-alpha-demethylase Q385E8 Q385E8_TRYB2 Trypanosoma brucei brucei 3 0.7049
Aldo-keto reductase family 1 member B1 P80276 ALDR_PIG Sus scrofa 2 0.7046
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7045
Phospholipase A2, major isoenzyme P00592 PA21B_PIG Sus scrofa 3 0.7044
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 3 0.7043
Histone deacetylase-like amidohydrolase Q70I53 HDAH_ALCSD Alcaligenes sp.) 2 0.7037
Glycogen phosphorylase, muscle form P00489 PYGM_RABIT Oryctolagus cuniculus 3 0.7030
Gag-Pol polyprotein P03366 POL_HV1B1 Human immunodeficiency virus type 1 group M subtype B 4 0.7017
Abscisic acid receptor PYL2 O80992 PYL2_ARATH Arabidopsis thaliana 2 0.7015
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 3 0.7014
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7014
Bromodomain-containing protein 2 P25440 BRD2_HUMAN Homo sapiens 2 0.7010
Retinol dehydratase Q26490 Q26490_SPOFR Spodoptera frugiperda 3 0.7007
Acetolactate synthase, chloroplastic P17597 ILVB_ARATH Arabidopsis thaliana 2 0.7003

Download SDF