BDBM50130370 4-Imidazol-1-ylmethyl-2-[3-(1-methyl-2-oxo-azepan-3-yl)-phenoxy]-benzonitrile::CHEMBL318923

SMILES: CN1CCCCC(c2cccc(Oc3cc(Cn4ccnc4)ccc3C#N)c2)C1=O

InChI Key: InChIKey=JHPYFDJWXXWGRB-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50130370   

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
Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50130370 (4-Imidazol-1-ylmethyl-2-[3-(1-methyl-2-oxo-azepan-...) Show SMILES CN1CCCCC(c2cccc(Oc3cc(Cn4ccnc4)ccc3C#N)c2)C1=O Show InChI InChI=1S/C24H24N4O2/c1-27-11-3-2-7-22(24(27)29)19-5-4-6-21(14-19)30-23-13-18(8-9-20(23)15-25)16-28-12-10-26-17-28/h4-6,8-10,12-14,17,22H,2-3,7,11,16H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Concentration required to inhibit recombinant human geranylgeranyl transferase type I (GGTase-I) catalyzed incorporation of [3H]GGPP to the C-terminu...				J Med Chem 46: 2973-84 (2003) Article DOI: 10.1021/jm020587n BindingDB Entry DOI: 10.7270/Q26Q1Z0P
					More data for this Ligand-Target Pair
Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50130370 (4-Imidazol-1-ylmethyl-2-[3-(1-methyl-2-oxo-azepan-...) Show SMILES CN1CCCCC(c2cccc(Oc3cc(Cn4ccnc4)ccc3C#N)c2)C1=O Show InChI InChI=1S/C24H24N4O2/c1-27-11-3-2-7-22(24(27)29)19-5-4-6-21(14-19)30-23-13-18(8-9-20(23)15-25)16-28-12-10-26-17-28/h4-6,8-10,12-14,17,22H,2-3,7,11,16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Concentration required to inhibit recombinant human farnesyltransferase (FTase) catalyzed incorporation of [3H]FPP into recombinant Ras-CVIM.				J Med Chem 46: 2973-84 (2003) Article DOI: 10.1021/jm020587n BindingDB Entry DOI: 10.7270/Q26Q1Z0P
					More data for this Ligand-Target Pair