Found 32 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Aromatase
(Homo sapiens (Human)) | BDBM50332824
((4S,8R,9S,10S,13S,14S)-4-hydroxy-10-(hydroxymethyl...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4[C@@H](O)CCC[C@]34CO)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O3/c1-18-10-8-14-12(13(18)6-7-17(18)22)4-5-15-16(21)3-2-9-19(14,15)11-20/h5,12-14,16,20-21H,2-4,6-11H2,1H3/t12-,13-,14-,16-,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50240798
((8R,9S,10R,13S,14S)-4-Hydroxy-10,13-dimethyl-1,6,7...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4C(=O)C(=O)CC[C@]34C)[C@@H]1CCC2=O |r| Show InChI InChI=1S/C19H26O3/c1-18-10-8-15(20)17(22)14(18)4-3-11-12-5-6-16(21)19(12,2)9-7-13(11)18/h11-14H,3-10H2,1-2H3/t11-,12-,13-,14?,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332808
((8R,9S,10S,13S,14S)-10-(hydroxymethyl)-13-methyl-2...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@]34CO)[C@@H]1CCC2=O |r,t:8| Show InChI InChI=1S/C19H28O2/c1-18-11-9-16-14(15(18)7-8-17(18)21)6-5-13-4-2-3-10-19(13,16)12-20/h4,14-16,20H,2-3,5-12H2,1H3/t14-,15-,16-,18-,19+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332810
((6R,8R,9S,10R,13S,14S)-6-hydroxy-10,13-dimethyl-2,...)Show SMILES C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CCCC[C@]34C)[C@@H]1CCC2=O |r,t:9| Show InChI InChI=1S/C19H28O2/c1-18-9-4-3-5-15(18)16(20)11-12-13-6-7-17(21)19(13,2)10-8-14(12)18/h5,12-14,16,20H,3-4,6-11H2,1-2H3/t12-,13-,14-,16+,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332807
((8R,9S,10R,13S,14S)-10,13-dimethyl-2,3,7,8,9,10,11...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@]34C)[C@@H]1CCC2=O |r,t:8| Show InChI InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h5,14-16H,3-4,6-12H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332805
((3R,4S,5R,8R,9S,10R,13S,14S)-10,13-Dimethyl-hexade...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4[C@@H]5O[C@@H]5CC[C@]34C)[C@@H]1CCC2=O |r| Show InChI InChI=1S/C19H28O2/c1-18-10-8-15-17(21-15)14(18)4-3-11-12-5-6-16(20)19(12,2)9-7-13(11)18/h11-15,17H,3-10H2,1-2H3/t11-,12-,13-,14-,15+,17-,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 145 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332809
((6S,8R,9S,10R,13S,14S)-6-hydroxy-10,13-dimethyl-2,...)Show SMILES C[C@]12CC[C@H]3[C@@H](C[C@H](O)C4=CCCC[C@]34C)[C@@H]1CCC2=O |r,t:9| Show InChI InChI=1S/C19H28O2/c1-18-9-4-3-5-15(18)16(20)11-12-13-6-7-17(21)19(13,2)10-8-14(12)18/h5,12-14,16,20H,3-4,6-11H2,1-2H3/t12-,13-,14-,16-,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332803
((5S,8R,9S,10S,13S,14S)-10,13-dimethyl-5,6,7,8,9,10...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C=CCC[C@]34C)[C@@H]1CCC2=O |r,c:9| Show InChI InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3,5,13-16H,4,6-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 225 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332818
((4S,8R,9S,10S,13S,14S)-4-hydroxy-10,13-dimethyl-3,...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4[C@@H](O)CCC[C@@]34C)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O2/c1-18-10-3-4-16(20)15(18)6-5-12-13-7-8-17(21)19(13,2)11-9-14(12)18/h6,12-14,16,20H,3-5,7-11H2,1-2H3/t12-,13-,14-,16-,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332813
((8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,6,7,...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=C(CCC[C@]34C)OC(=O)c3ccccc3)[C@@H]1CCC2=O |r,t:8| Show InChI InChI=1S/C26H32O3/c1-25-15-6-9-22(29-24(28)17-7-4-3-5-8-17)21(25)11-10-18-19-12-13-23(27)26(19,2)16-14-20(18)25/h3-5,7-8,18-20H,6,9-16H2,1-2H3/t18-,19-,20-,25+,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 640 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332814
((8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,6,7,...)Show SMILES CC(=O)OC1=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1 |r,c:4| Show InChI InChI=1S/C21H30O3/c1-13(22)24-18-5-4-11-20(2)16-10-12-21(3)15(8-9-19(21)23)14(16)6-7-17(18)20/h14-16H,4-12H2,1-3H3/t14-,15-,16-,20+,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332832
((8R,9S,10S,13S,14S)-10,13-dimethyl-3,4,7,8,9,10,11...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4CCCC[C@@]34C)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h6,14-16H,3-5,7-12H2,1-2H3/t14-,15-,16-,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332830
((3R,5R,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C(=O)[C@H](O)CC[C@]34C)[C@@H]1CCC2=O |r| Show InChI InChI=1S/C19H28O3/c1-18-10-8-15(20)17(22)14(18)4-3-11-12-5-6-16(21)19(12,2)9-7-13(11)18/h11-15,20H,3-10H2,1-2H3/t11-,12-,13-,14-,15+,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 670 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332819
((8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-2,3,4,7,...)Show SMILES CC(=O)OC1CCC[C@@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:24| Show InChI InChI=1S/C21H30O3/c1-13(22)24-18-5-4-11-20(2)16-10-12-21(3)15(8-9-19(21)23)14(16)6-7-17(18)20/h7,14-16,18H,4-6,8-12H2,1-3H3/t14-,15-,16-,18?,20-,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332822
((4R,8R,9S,10S,13S,14S)-4-hydroxy-10,13-dimethyl-3,...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4[C@H](O)CCC[C@@]34C)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O2/c1-18-10-3-4-16(20)15(18)6-5-12-13-7-8-17(21)19(13,2)11-9-14(12)18/h6,12-14,16,20H,3-5,7-11H2,1-2H3/t12-,13-,14-,16+,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 860 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332817
((6R,8R,9S,10S,13S,14S)-6-hydroxy-10-(hydroxymethyl...)Show SMILES C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CCCC[C@]34CO)[C@@H]1CCC2=O |r,t:9| Show InChI InChI=1S/C19H28O3/c1-18-9-7-14-12(13(18)5-6-17(18)22)10-16(21)15-4-2-3-8-19(14,15)11-20/h4,12-14,16,20-21H,2-3,5-11H2,1H3/t12-,13-,14-,16+,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 940 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332816
((6S,8R,9S,10S,13S,14S)-6-hydroxy-10-(hydroxymethyl...)Show SMILES C[C@]12CC[C@H]3[C@@H](C[C@H](O)C4=CCCC[C@]34CO)[C@@H]1CCC2=O |r,t:9| Show InChI InChI=1S/C19H28O3/c1-18-9-7-14-12(13(18)5-6-17(18)22)10-16(21)15-4-2-3-8-19(14,15)11-20/h4,12-14,16,20-21H,2-3,5-11H2,1H3/t12-,13-,14-,16-,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332820
((8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,4,7,...)Show SMILES CC(=O)OC1CCC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:24| Show InChI InChI=1S/C21H30O3/c1-13(22)24-18-5-4-11-20(2)16-10-12-21(3)15(8-9-19(21)23)14(16)6-7-17(18)20/h7,14-16,18H,4-6,8-12H2,1-3H3/t14-,15-,16-,18?,20+,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332811
((8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,6,7,...)Show SMILES CCCC(=O)OC1=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1 |r,c:6| Show InChI InChI=1S/C23H34O3/c1-4-6-21(25)26-19-7-5-13-22(2)17-12-14-23(3)16(10-11-20(23)24)15(17)8-9-18(19)22/h15-17H,4-14H2,1-3H3/t15-,16-,17-,22+,23-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332812
((8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,3,6,7,...)Show SMILES CCCCCC(=O)OC1=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1 |r,c:8| Show InChI InChI=1S/C25H38O3/c1-4-5-6-9-23(27)28-21-8-7-15-24(2)19-14-16-25(3)18(12-13-22(25)26)17(19)10-11-20(21)24/h17-19H,4-16H2,1-3H3/t17-,18-,19-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332826
((4S,8R,9S,10R,13S,14S)-4,10,13-trimethyl-3,4,7,8,9...)Show SMILES C[C@H]1CCC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:21| Show InChI InChI=1S/C20H30O/c1-13-5-4-11-19(2)15(13)7-6-14-16-8-9-18(21)20(16,3)12-10-17(14)19/h7,13-14,16-17H,4-6,8-12H2,1-3H3/t13-,14-,16-,17-,19-,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332831
((4betaR,10alphaR,10betaS,12alphaS)-7-hydroxy-10alp...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4C(=O)C(=O)CC[C@]34C)[C@@H]1CCC(=O)O2 |r| Show InChI InChI=1S/C19H26O4/c1-18-9-8-15(20)17(22)14(18)4-3-11-12(18)7-10-19(2)13(11)5-6-16(21)23-19/h11-14H,3-10H2,1-2H3/t11-,12+,13+,14?,18-,19+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332829
((5R,8R,9S,10R,13S,14S)-10,13-dimethyldodecahydro-1...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C(=O)CCC[C@]34C)[C@@H]1CCC2=O |r| Show InChI InChI=1S/C19H28O2/c1-18-10-3-4-16(20)15(18)6-5-12-13-7-8-17(21)19(13,2)11-9-14(12)18/h12-15H,3-11H2,1-2H3/t12-,13-,14-,15-,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332815
((8R,9S,10S,13S,14S)-10-(hydroxymethyl)-13-methyl-1...)Show SMILES CC(=O)OC1=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3[C@@]2(CO)CCC1 |r,c:4| Show InChI InChI=1S/C21H30O4/c1-13(23)25-18-4-3-10-21(12-22)16-9-11-20(2)15(7-8-19(20)24)14(16)5-6-17(18)21/h14-16,22H,3-12H2,1-2H3/t14-,15-,16-,20-,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332827
((4S,8R,9S,10R,13S,14S)-4-ethyl-10,13-dimethyl-3,4,...)Show SMILES CC[C@H]1CCC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:22| Show InChI InChI=1S/C21H32O/c1-4-14-6-5-12-20(2)16(14)8-7-15-17-9-10-19(22)21(17,3)13-11-18(15)20/h8,14-15,17-18H,4-7,9-13H2,1-3H3/t14-,15-,17-,18-,20-,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332828
((4S,8R,9S,10R,13S,14S)-10,13-dimethyl-4-propyl-3,4...)Show SMILES CCC[C@H]1CCC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:23| Show InChI InChI=1S/C22H34O/c1-4-6-15-7-5-13-21(2)17(15)9-8-16-18-10-11-20(23)22(18,3)14-12-19(16)21/h9,15-16,18-19H,4-8,10-14H2,1-3H3/t15-,16-,18-,19-,21-,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332806
((3R,4S,5R,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-he...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4[C@@H]5O[C@@H]5CC[C@]34C)[C@@H]1CC[C@@H]2O |r| Show InChI InChI=1S/C19H30O2/c1-18-10-8-15-17(21-15)14(18)4-3-11-12-5-6-16(20)19(12,2)9-7-13(11)18/h11-17,20H,3-10H2,1-2H3/t11-,12-,13-,14-,15+,16-,17-,18+,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332823
((4R,8R,9S,10S,13S,14S)-4-hydroxy-10-(hydroxymethyl...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4[C@H](O)CCC[C@]34CO)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O3/c1-18-10-8-14-12(13(18)6-7-17(18)22)4-5-15-16(21)3-2-9-19(14,15)11-20/h5,12-14,16,20-21H,2-4,6-11H2,1H3/t12-,13-,14-,16+,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332833
((8R,9S,10S,13S,14S)-10-(hydroxymethyl)-13-methyl-3...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4CCCC[C@]34CO)[C@@H]1CCC2=O |r,t:7| Show InChI InChI=1S/C19H28O2/c1-18-11-9-16-14(15(18)7-8-17(18)21)6-5-13-4-2-3-10-19(13,16)12-20/h5,14-16,20H,2-4,6-12H2,1H3/t14-,15-,16-,18-,19+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332821
((8R,9S,10S,13S,14S)-10-(hydroxymethyl)-13-methyl-1...)Show SMILES CC(=O)OC1CCC[C@]2(CO)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:25| Show InChI InChI=1S/C21H30O4/c1-13(23)25-18-4-3-10-21(12-22)16-9-11-20(2)15(7-8-19(20)24)14(16)5-6-17(18)21/h6,14-16,18,22H,3-5,7-12H2,1-2H3/t14-,15-,16-,18?,20-,21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332804
((5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-2,5,6,7,...)Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C=CCC[C@]34C)[C@@H]1CC[C@@H]2O |r,c:9| Show InChI InChI=1S/C19H30O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3,5,13-17,20H,4,6-12H2,1-2H3/t13-,14+,15+,16+,17+,18+,19+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50332825
((4S,8R,9S,10S,13S,14S)-10-(hydroxymethyl)-4-methox...)Show SMILES CO[C@H]1CCC[C@]2(CO)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:23| Show InChI InChI=1S/C20H30O3/c1-19-11-9-15-13(14(19)7-8-18(19)22)5-6-16-17(23-2)4-3-10-20(15,16)12-21/h6,13-15,17,21H,3-5,7-12H2,1-2H3/t13-,14-,15-,17-,19-,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human placental aromatase |
Eur J Med Chem 45: 5612-20 (2010)
Checked by Author
Article DOI: 10.1016/j.ejmech.2010.09.011
BindingDB Entry DOI: 10.7270/Q2G44QH8 |
More data for this
Ligand-Target Pair | |
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