BDBM50332805 (3R,4S,5R,8R,9S,10R,13S,14S)-10,13-Dimethyl-hexadecahydro-20-oxa-cyclopropa[3,4]cyclopenta[alpha]phenanthren-17-one::CHEMBL1629802
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
InChI Key: InChIKey=ALHYGULCJHAJFX-CWBKUMBBSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cytochrome P450 19A1 (Homo sapiens (Human)) | BDBM50332805 ((3R,4S,5R,8R,9S,10R,13S,14S)-10,13-Dimethyl-hexade...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Coimbra Curated by ChEMBL | Assay Description Inhibition of aromatase in human microsomes using [1beta-3H]androstenedione as substrate after 5 mins by Dixon plot analysis | J Med Chem 55: 3992-4002 (2012) Article DOI: 10.1021/jm300262w BindingDB Entry DOI: 10.7270/Q22V2H52 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 19A1 (Homo sapiens (Human)) | BDBM50332805 ((3R,4S,5R,8R,9S,10R,13S,14S)-10,13-Dimethyl-hexade...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 | |||||||||||||
Cytochrome P450 19A1 (Homo sapiens (Human)) | BDBM50332805 ((3R,4S,5R,8R,9S,10R,13S,14S)-10,13-Dimethyl-hexade...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 |
University of Coimbra Curated by ChEMBL | Assay Description Inhibition of aromatase in human placental microsomes using [1beta-3H]androstenedione as substrate after 15 mins by liquid scintillation counting | J Med Chem 55: 3992-4002 (2012) Article DOI: 10.1021/jm300262w BindingDB Entry DOI: 10.7270/Q22V2H52 | |||||||||||
More data for this Ligand-Target Pair |