Found 8 hits in this display 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 |
Cytochrome P450 11B1, mitochondrial
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human CYP11B1 expressed in hamster V79MZh cells using [1,2-3H]-11-deoxycorticosterone as substrate |
J Med Chem 56: 1723-9 (2013)
Article DOI: 10.1021/jm301844q BindingDB Entry DOI: 10.7270/Q22808ZV |
More data for this Ligand-Target Pair | |
Cytochrome P450 11B2, mitochondrial
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB
UniProtKB/SwissProt
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 |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human CYP11B2 expressed in hamster V79MZh cells using [1,2-3H]-11-deoxycorticosterone as substrate |
J Med Chem 56: 1723-9 (2013)
Article DOI: 10.1021/jm301844q BindingDB Entry DOI: 10.7270/Q22808ZV |
More data for this Ligand-Target Pair | |
Steroid 17-alpha-hydroxylase/17,20 lyase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human testicular microsome Steroid 17-alpha-hydroxylase/17,20 lyase |
J Med Chem 44: 672-80 (2001)
BindingDB Entry DOI: 10.7270/Q28S4P6H |
More data for this Ligand-Target Pair | |
Steroid 17-alpha-hydroxylase/17,20 lyase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Accelrys
Curated by ChEMBL
| Assay Description In vitro inhibition of human Cytochrome P450 17A1 activity |
J Med Chem 46: 2345-51 (2003)
Article DOI: 10.1021/jm020576u BindingDB Entry DOI: 10.7270/Q2WD41B7 |
More data for this Ligand-Target Pair | |
Steroid 17-alpha-hydroxylase/17,20 lyase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human CYP17 expressed in Escherichia coli co-expressing rat NADPH-P450-reductase using progesterone as substrate |
J Med Chem 56: 1723-9 (2013)
Article DOI: 10.1021/jm301844q BindingDB Entry DOI: 10.7270/Q22808ZV |
More data for this Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 970 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human placental microsome cytochrome P450 19A1 aromatase |
J Med Chem 44: 672-80 (2001)
BindingDB Entry DOI: 10.7270/Q28S4P6H |
More data for this Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | 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 | 970 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description Inhibition of human placental CYP19 using [1beta-3H]androstenedione as substrate by 3H2O-method |
J Med Chem 56: 1723-9 (2013)
Article DOI: 10.1021/jm301844q BindingDB Entry DOI: 10.7270/Q22808ZV |
More data for this Ligand-Target Pair | |
Aromatase
(Homo sapiens (Human)) | BDBM50097363
(1-((1H-imidazol-1-yl)methyl)-4-nitro-9H-xanthen-9-...)Show SMILES [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O Show InChI InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2 | 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 | 970 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Coimbra
Curated by ChEMBL
| Assay Description Inhibition of human aromatase-mediated conversion of [1beta3H]androstenedione to estrone by liquid scintillation counting in presence of NADPH |
J Med Chem 52: 143-50 (2009)
Article DOI: 10.1021/jm800945c BindingDB Entry DOI: 10.7270/Q2SQ9080 |
More data for this Ligand-Target Pair | |