Isopropylbenzene - Compound Card

Isopropylbenzene

Select a section from the left sidebar

Isopropylbenzene

Structure
Zoomed Structure
  • Family: Plantae - Burseraceae
  • Kingdom: Plantae
  • Class: Monoaromatic
Canonical Smiles CC(c1ccccc1)C
InChI InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey RWGFKTVRMDUZSP-UHFFFAOYSA-N
Formula C9H12
HBA 0
HBD 0
MW 120.19
Rotatable Bonds 1
TPSA 0.0
LogP 2.81
Number Rings 1
Number Aromatic Rings 1
Heavy Atom Count 9
Formal Charge 0
Fraction CSP3 0.33
Exact Mass 120.09
Number of Lipinski Rule Violations 0
# Species Family Kingdom NCBI Taxonomy ID
1 Commiphora quadricincta Burseraceae Plantae 2248429

Showing of synonyms

  • Assad YOH, Torto B, et al. (1997). Seasonal variation in the essential oil composition of Commiphora quadricincta and its effect on the maturation of immature adults of the desert locust, Schistocerca gregaria. Phytochemistry,1997,44(5),833-841. [View] [PubMed]
Pubchem: 7406
Kegg Ligand: C14396
Chebi: 34656
Nmrshiftdb2: 10008586
CPRiL: 22263
Structure

SMILES: c1ccccc1

Level: 0

Mol. Weight: 120.19 g/mol

No bioactivities available.

Absorption

Caco-2 (logPapp)
-3.96
Human Oral Bioavailability 20%
Bioavailable
Human Intestinal Absorption
Absorbed
Madin-Darby Canine Kidney
-3.57
Human Oral Bioavailability 50%
Bioavailable
P-Glycoprotein Inhibitor
Non-Inhibitor
P-Glycoprotein Substrate
Non-Substrate
Skin Permeability
-3.15

Distribution

Blood-Brain Barrier (CNS)
-
Blood-Brain Barrier
Penetrable
Fraction Unbound (Human)
0.69
Plasma Protein Binding
22.34
Steady State Volume of Distribution
-

Metabolism

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

Excretion

Clearance
7.02
Organic Cation Transporter 2
Non-Inhibitor
Half-Life of Drug
-

Toxicity

AMES Mutagenesis
Safe
Avian
Safe
Bee
Safe
Bioconcentration Factor
2.22
Biodegradation
Safe
Carcinogenesis
Toxic
Crustacean
Toxic
Liver Injury I (DILI)
Safe
Eye Corrosion
Toxic
Eye Irritation
Toxic
Maximum Tolerated Dose
-0.08
Liver Injury II
Toxic
hERG Blockers
Safe
Daphnia Maga
4.01
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
3.56
Rat (Acute)
1.62
Rat (Chronic Oral)
2.0
Fathead Minnow
3.72
Respiratory Disease
Safe
Skin Sensitisation
Toxic
SR-ARE
Safe
SR-ATAD5
Safe
SR-HSE
Safe
SR-MMP
Safe
SR-p53
Safe

General Properties

Boiling Point
155.55
Hydration Free Energy
-0.28
Log(D) at pH=7.4
2.73
Log(P)
3.63
Log S
-3.29
Log(Vapor Pressure)
0.55
Melting Point
-83.78
pKa Acid
14.41
pKa Basic
9.4
Protein Name UniProt ID Entry Name Species #Pharmacophore Points Probability (0.7 ≤ Tversky Score ≤ 1.0)
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 2 0.8622
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 2 0.8622
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.8592
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.8592
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.8117
Pentaerythritol tetranitrate reductase P71278 P71278_ENTCL Enterobacter cloacae 2 0.8117
Fatty acid-binding protein, liver P80226 FABPL_CHICK Gallus gallus 2 0.8048
Fatty acid-binding protein, liver P80226 FABPL_CHICK Gallus gallus 2 0.8048
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.8021
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.8021
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 2 0.8012
Acetylcholinesterase P04058 ACES_TETCF Tetronarce californica 2 0.8012
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7967
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7967
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7929
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7929
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7912
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7912
Bifunctional dihydrofolate reductase-thymidylate synthase P13922 DRTS_PLAFK Plasmodium falciparum 2 0.7910
Bifunctional dihydrofolate reductase-thymidylate synthase P13922 DRTS_PLAFK Plasmodium falciparum 2 0.7910
Nuclear receptor ROR-gamma P51449 RORG_HUMAN Homo sapiens 2 0.7903
Nuclear receptor ROR-gamma P51449 RORG_HUMAN Homo sapiens 2 0.7903
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7882
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7882
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7870
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7870
Abscisic acid receptor PYL3 Q9SSM7 PYL3_ARATH Arabidopsis thaliana 2 0.7869
Abscisic acid receptor PYL3 Q9SSM7 PYL3_ARATH Arabidopsis thaliana 2 0.7869
Lactoylglutathione lyase Q9CPU0 LGUL_MOUSE Mus musculus 2 0.7868
Lactoylglutathione lyase Q9CPU0 LGUL_MOUSE Mus musculus 2 0.7868
Aromatase P11511 CP19A_HUMAN Homo sapiens 2 0.7861
Aromatase P11511 CP19A_HUMAN Homo sapiens 2 0.7861
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7860
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7860
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7851
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7851
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7842
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7842
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7841
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7841
11-beta-hydroxysteroid dehydrogenase 1 P50172 DHI1_MOUSE Mus musculus 2 0.7837
11-beta-hydroxysteroid dehydrogenase 1 P50172 DHI1_MOUSE Mus musculus 2 0.7837
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7829
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7829
Lactoylglutathione lyase Q04760 LGUL_HUMAN Homo sapiens 2 0.7808
Lactoylglutathione lyase Q04760 LGUL_HUMAN Homo sapiens 2 0.7808
Aldo-keto reductase family 1 member C1 Q04828 AK1C1_HUMAN Homo sapiens 2 0.7788
Aldo-keto reductase family 1 member C1 Q04828 AK1C1_HUMAN Homo sapiens 2 0.7788
Progesterone receptor P06401 PRGR_HUMAN Homo sapiens 2 0.7785
Progesterone receptor P06401 PRGR_HUMAN Homo sapiens 2 0.7785
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7771
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7771
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7762
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7762
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 2 0.7758
3',5'-cyclic-AMP phosphodiesterase 4D Q08499 PDE4D_HUMAN Homo sapiens 2 0.7758
Casein kinase II subunit alpha' P19784 CSK22_HUMAN Homo sapiens 2 0.7752
Casein kinase II subunit alpha' P19784 CSK22_HUMAN Homo sapiens 2 0.7752
Prostaglandin reductase 2 Q8N8N7 PTGR2_HUMAN Homo sapiens 2 0.7745
Prostaglandin reductase 2 Q8N8N7 PTGR2_HUMAN Homo sapiens 2 0.7745
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7743
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7743
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7739
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7739
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7732
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7732
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7731
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7731
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7726
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7726
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7725
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7725
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7721
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7721
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7718
Retinoic acid receptor RXR-alpha P19793 RXRA_HUMAN Homo sapiens 2 0.7718
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7713
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7713
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7709
Mineralocorticoid receptor P08235 MCR_HUMAN Homo sapiens 2 0.7709
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 2 0.7696
Succinate dehydrogenase flavoprotein subunit P0AC41 SDHA_ECOLI Escherichia coli 2 0.7696
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7693
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7693
Steroid 21-hydroxylase P08686 CP21A_HUMAN Homo sapiens 2 0.7692
Steroid 21-hydroxylase P08686 CP21A_HUMAN Homo sapiens 2 0.7692
Thymidine kinase P0DTH5 KITH_HHV11 Human herpesvirus 1 2 0.7671
Thymidine kinase P0DTH5 KITH_HHV11 Human herpesvirus 1 2 0.7671
Pteridine reductase O76290 O76290_TRYBB Trypanosoma brucei brucei 2 0.7662
Pteridine reductase O76290 O76290_TRYBB Trypanosoma brucei brucei 2 0.7662
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7651
Pheromone-binding protein ASP1 Q9U9J6 Q9U9J6_APIME Apis mellifera 2 0.7651
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7644
Aldo-keto reductase family 1 member D1 P51857 AK1D1_HUMAN Homo sapiens 2 0.7644
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 2 0.7630
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 2 0.7630
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 2 0.7618
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 2 0.7618
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7615
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7615
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7609
Steroid Delta-isomerase P00947 SDIS_COMTE Comamonas testosteroni 2 0.7609
Sex hormone-binding globulin P04278 SHBG_HUMAN Homo sapiens 2 0.7608
Sex hormone-binding globulin P04278 SHBG_HUMAN Homo sapiens 2 0.7608
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7607
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7607
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7601
Albumin P02768 ALBU_HUMAN Homo sapiens 2 0.7601
Corticosteroid-binding globulin P08185 CBG_HUMAN Homo sapiens 2 0.7596
Corticosteroid-binding globulin P08185 CBG_HUMAN Homo sapiens 2 0.7596
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7590
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7590
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7587
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7587
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7582
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7582
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7573
Ribosyldihydronicotinamide dehydrogenase [quinone] P16083 NQO2_HUMAN Homo sapiens 2 0.7573
Dicamba O-demethylase, oxygenase component Q5S3I3 DDMC_STEMA Stenotrophomonas maltophilia 2 0.7571
Dicamba O-demethylase, oxygenase component Q5S3I3 DDMC_STEMA Stenotrophomonas maltophilia 2 0.7571
NPC intracellular cholesterol transporter 1 O15118 NPC1_HUMAN Homo sapiens 2 0.7570
NPC intracellular cholesterol transporter 1 O15118 NPC1_HUMAN Homo sapiens 2 0.7570
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 2 0.7570
Acetylcholinesterase P21836 ACES_MOUSE Mus musculus 2 0.7570
Acetylcholinesterase P22303 ACES_HUMAN Homo sapiens 2 0.7567
Acetylcholinesterase P22303 ACES_HUMAN Homo sapiens 2 0.7567
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 2 0.7562
CmeR Q7B8P6 Q7B8P6_CAMJU Campylobacter jejuni 2 0.7562
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 2 0.7560
Sulfotransferase 1A1 P50225 ST1A1_HUMAN Homo sapiens 2 0.7560
Trichodiene synthase P13513 TRI5_FUSSP Fusarium sporotrichioides 2 0.7547
Trichodiene synthase P13513 TRI5_FUSSP Fusarium sporotrichioides 2 0.7547
Rhodopsin P02699 OPSD_BOVIN Bos taurus 2 0.7538
Rhodopsin P02699 OPSD_BOVIN Bos taurus 2 0.7538
Progesterone receptor P06401 PRGR_HUMAN Homo sapiens 2 0.7535
Progesterone receptor P06401 PRGR_HUMAN Homo sapiens 2 0.7535
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 2 0.7516
Sulfotransferase 2B1 O00204 ST2B1_HUMAN Homo sapiens 2 0.7516
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7515
Soluble cytochrome b562 P0ABE7 C562_ECOLX Escherichia coli 2 0.7515
3-alpha-hydroxysteroid dehydrogenase P23457 DIDH_RAT Rattus norvegicus 2 0.7512
3-alpha-hydroxysteroid dehydrogenase P23457 DIDH_RAT Rattus norvegicus 2 0.7512
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7507
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7507
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7489
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7489
Neocarzinostatin P0A3R9 NCZS_STRCZ Streptomyces carzinostaticus 2 0.7483
Neocarzinostatin P0A3R9 NCZS_STRCZ Streptomyces carzinostaticus 2 0.7483
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7467
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7467
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7452
Carminomycin 4-O-methyltransferase DnrK Q06528 DNRK_STRPE Streptomyces peucetius 2 0.7452
Heat shock protein HSP 90-alpha P07900 HS90A_HUMAN Homo sapiens 2 0.7452
Carminomycin 4-O-methyltransferase DnrK Q06528 DNRK_STRPE Streptomyces peucetius 2 0.7452
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7426
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7426
Gastrotropin Q6IMW5 Q6IMW5_DANRE Danio rerio 2 0.7423
Gastrotropin Q6IMW5 Q6IMW5_DANRE Danio rerio 2 0.7423
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7415
Aldo-keto reductase family 1 member B1 P15121 ALDR_HUMAN Homo sapiens 2 0.7415
3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase O33877 FABA_PSEAE Pseudomonas aeruginosa 2 0.7408
3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase O33877 FABA_PSEAE Pseudomonas aeruginosa 2 0.7408
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7397
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7397
D(3) dopamine receptor P35462 DRD3_HUMAN Homo sapiens 2 0.7395
D(3) dopamine receptor P35462 DRD3_HUMAN Homo sapiens 2 0.7395
Sulfotransferase 2A1 Q06520 ST2A1_HUMAN Homo sapiens 2 0.7387
Sulfotransferase 2A1 Q06520 ST2A1_HUMAN Homo sapiens 2 0.7387
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7385
Photosynthetic reaction center cytochrome c subunit P07173 CYCR_BLAVI Blastochloris viridis 2 0.7385
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7373
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7373
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7371
Aromatic-amino-acid aminotransferase P95468 TYRB_PARDE Paracoccus denitrificans 2 0.7371
Beta-2 adrenergic receptor P07550 ADRB2_HUMAN Homo sapiens 2 0.7368
Beta-2 adrenergic receptor P07550 ADRB2_HUMAN Homo sapiens 2 0.7368
glutaryl-CoA dehydrogenase (ETF) Q3JP94 Q3JP94_BURP1 Burkholderia pseudomallei 2 0.7362
glutaryl-CoA dehydrogenase (ETF) Q3JP94 Q3JP94_BURP1 Burkholderia pseudomallei 2 0.7362
Retinol-binding protein 4 P18902 RET4_BOVIN Bos taurus 2 0.7357
Retinol-binding protein 4 P18902 RET4_BOVIN Bos taurus 2 0.7357
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7354
17-beta-hydroxysteroid dehydrogenase type 1 P14061 DHB1_HUMAN Homo sapiens 2 0.7354
Acetylcholine-binding protein P58154 ACHP_LYMST Lymnaea stagnalis 2 0.7319
Acetylcholine-binding protein P58154 ACHP_LYMST Lymnaea stagnalis 2 0.7319
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7310
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7310
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 2 0.7296
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A O76083 PDE9A_HUMAN Homo sapiens 2 0.7296
Beta-lactoglobulin P02754 LACB_BOVIN Bos taurus 2 0.7291
Beta-lactoglobulin P02754 LACB_BOVIN Bos taurus 2 0.7291
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7278
Steroid Delta-isomerase P07445 SDIS_PSEPU Pseudomonas putida 2 0.7278
Steroid 17-alpha-hydroxylase/17,20 lyase P05093 CP17A_HUMAN Homo sapiens 2 0.7276
Steroid 17-alpha-hydroxylase/17,20 lyase P05093 CP17A_HUMAN Homo sapiens 2 0.7276
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7253
Cytochrome P450 monooxygenase Q5YNS8 Q5YNS8_NOCFA Nocardia farcinica 2 0.7253
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 2 0.7240
cGMP-dependent 3',5'-cyclic phosphodiesterase O00408 PDE2A_HUMAN Homo sapiens 2 0.7240
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7222
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase Q05603 COBT_SALTY Salmonella typhimurium 2 0.7222
Nuclear receptor ROR-beta P45446 RORB_RAT Rattus norvegicus 2 0.7211
Nuclear receptor ROR-beta P45446 RORB_RAT Rattus norvegicus 2 0.7211
Alcohol dehydrogenase 1C P00326 ADH1G_HUMAN Homo sapiens 2 0.7205
Alcohol dehydrogenase 1C P00326 ADH1G_HUMAN Homo sapiens 2 0.7205
Beta-2 adrenergic receptor P07550 ADRB2_HUMAN Homo sapiens 2 0.7197
Beta-2 adrenergic receptor P07550 ADRB2_HUMAN Homo sapiens 2 0.7197
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7189
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7189
4-diphosphocytidyl-2-C-methyl-D-erythritol kinase O67060 ISPE_AQUAE Aquifex aeolicus 2 0.7178
4-diphosphocytidyl-2-C-methyl-D-erythritol kinase O67060 ISPE_AQUAE Aquifex aeolicus 2 0.7178
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7164
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7164
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7148
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7148
D-alanine--D-alanine ligase Q5HEB7 DDL_STAAC Staphylococcus aureus 2 0.7141
D-alanine--D-alanine ligase Q5HEB7 DDL_STAAC Staphylococcus aureus 2 0.7141
Aromatase P11511 CP19A_HUMAN Homo sapiens 2 0.7136
Aromatase P11511 CP19A_HUMAN Homo sapiens 2 0.7136
Acyl-coenzyme A synthetase ACSM2A, mitochondrial Q08AH3 ACS2A_HUMAN Homo sapiens 2 0.7106
Acyl-coenzyme A synthetase ACSM2A, mitochondrial Q08AH3 ACS2A_HUMAN Homo sapiens 2 0.7106
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7099
Androgen receptor P10275 ANDR_HUMAN Homo sapiens 2 0.7099
NADH:flavin oxidoreductase Sye1 Q8EEC8 Q8EEC8_SHEON Shewanella oneidensis 2 0.7088
NADH:flavin oxidoreductase Sye1 Q8EEC8 Q8EEC8_SHEON Shewanella oneidensis 2 0.7088
Integrin alpha-L P20701 ITAL_HUMAN Homo sapiens 2 0.7062
Integrin alpha-L P20701 ITAL_HUMAN Homo sapiens 2 0.7062
Cytochrome P450 2A6 P11509 CP2A6_HUMAN Homo sapiens 2 0.7045
Cytochrome P450 2A6 P11509 CP2A6_HUMAN Homo sapiens 2 0.7045
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7032
Chitinase A Q9AMP1 Q9AMP1_VIBHA Vibrio harveyi 2 0.7032
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7027
Aldo-keto reductase family 1 member C2 P52895 AK1C2_HUMAN Homo sapiens 2 0.7027
Achbp I6L8L2 I6L8L2_CAPTE Capitella teleta 2 0.7009
Achbp I6L8L2 I6L8L2_CAPTE Capitella teleta 2 0.7009

Download SDF