BDBM50029230 2-Methyl-2-pyridin-3-yl-propionic acid 2-methyl-adamantan-2-yl ester::CHEMBL3084923
SMILES: CC(C)(C(=O)OC1(C)C2CC3CC(C2)CC1C3)c1cccnc1
InChI Key: InChIKey=NHPHHPFRHSBYCP-UHFFFAOYSA-N
Data: 3 IC50
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)) | BDBM50029230![]() (2-Methyl-2-pyridin-3-yl-propionic acid 2-methyl-ad...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
CRC Laboratory Curated by ChEMBL | Assay Description Tested for inhibition of human placental Cytochrome P450 19A1 | J Med Chem 38: 4191-7 (1995) BindingDB Entry DOI: 10.7270/Q2NK3D2C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 17A1 (Homo sapiens (Human)) | BDBM50029230![]() (2-Methyl-2-pyridin-3-yl-propionic acid 2-methyl-ad...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
CRC Laboratory Curated by ChEMBL | Assay Description Tested for inhibition of human testicular C17,20-Lyase. | J Med Chem 38: 4191-7 (1995) BindingDB Entry DOI: 10.7270/Q2NK3D2C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 17A1 (Homo sapiens (Human)) | BDBM50029230![]() (2-Methyl-2-pyridin-3-yl-propionic acid 2-methyl-ad...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
CRC Laboratory Curated by ChEMBL | Assay Description Tested for inhibition of human testicular C17,20-Lyase. | J Med Chem 38: 4191-7 (1995) BindingDB Entry DOI: 10.7270/Q2NK3D2C | |||||||||||
More data for this Ligand-Target Pair |