BDBM50342180 CHEMBL1766181::rac-1-(1H-Imidazol-4-yl)-2-methyl-1-[4-(2-pyridinyl)phenyl]-1-propanol

SMILES: CC(C)C(O)(c1cnc[nH]1)c1ccc(cc1)-c1ccccn1

InChI Key: InChIKey=KPCAQRVDZSQEMF-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50342180   

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 17A1 (Rattus norvegicus (Rat))	BDBM50342180 (CHEMBL1766181 | rac-1-(1H-Imidazol-4-yl)-2-methyl-...) Show SMILES CC(C)C(O)(c1cnc[nH]1)c1ccc(cc1)-c1ccccn1 Show InChI InChI=1S/C18H19N3O/c1-13(2)18(22,17-11-19-12-21-17)15-8-6-14(7-9-15)16-5-3-4-10-20-16/h3-13,22H,1-2H3,(H,19,21)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of 17,20 lyase activity in Sprague-Dawley rat testicular microsomes				Bioorg Med Chem 19: 2428-42 (2011) Article DOI: 10.1016/j.bmc.2011.02.009 BindingDB Entry DOI: 10.7270/Q2FJ2H3G
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50342180 (CHEMBL1766181 | rac-1-(1H-Imidazol-4-yl)-2-methyl-...) Show SMILES CC(C)C(O)(c1cnc[nH]1)c1ccc(cc1)-c1ccccn1 Show InChI InChI=1S/C18H19N3O/c1-13(2)18(22,17-11-19-12-21-17)15-8-6-14(7-9-15)16-5-3-4-10-20-16/h3-13,22H,1-2H3,(H,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human CYP3A4 after 30 mins				Bioorg Med Chem 19: 2428-42 (2011) Article DOI: 10.1016/j.bmc.2011.02.009 BindingDB Entry DOI: 10.7270/Q2FJ2H3G
					More data for this Ligand-Target Pair
Cytochrome P450 17A1 (Homo sapiens (Human))	BDBM50342180 (CHEMBL1766181 | rac-1-(1H-Imidazol-4-yl)-2-methyl-...) Show SMILES CC(C)C(O)(c1cnc[nH]1)c1ccc(cc1)-c1ccccn1 Show InChI InChI=1S/C18H19N3O/c1-13(2)18(22,17-11-19-12-21-17)15-8-6-14(7-9-15)16-5-3-4-10-20-16/h3-13,22H,1-2H3,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human 17,20 lyase activity				Bioorg Med Chem 19: 2428-42 (2011) Article DOI: 10.1016/j.bmc.2011.02.009 BindingDB Entry DOI: 10.7270/Q2FJ2H3G
					More data for this Ligand-Target Pair