BDBM50387701 CHEMBL2057220

SMILES: CCC(=O)c1ccc(cc1)N(C)C(=O)CSc1nnc(CNc2ccccc2)n1CC

InChI Key: InChIKey=CKIITEBNXSZOPN-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 = 50387701   

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
Long-chain fatty acid transport protein 1 (Homo sapiens (Human))	BDBM50387701 (CHEMBL2057220) Show SMILES CCC(=O)c1ccc(cc1)N(C)C(=O)CSc1nnc(CNc2ccccc2)n1CC Show InChI InChI=1S/C23H27N5O2S/c1-4-20(29)17-11-13-19(14-12-17)27(3)22(30)16-31-23-26-25-21(28(23)5-2)15-24-18-9-7-6-8-10-18/h6-14,24H,4-5,15-16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human recombinant FATP1 acyl-coA synthetase activity using [14C]oleic acid as substrate				Bioorg Med Chem Lett 22: 5067-70 (2012) Article DOI: 10.1016/j.bmcl.2012.05.130 BindingDB Entry DOI: 10.7270/Q2VD70HW
					More data for this Ligand-Target Pair
Long-chain fatty acid transport protein 1 (Mus musculus)	BDBM50387701 (CHEMBL2057220) Show SMILES CCC(=O)c1ccc(cc1)N(C)C(=O)CSc1nnc(CNc2ccccc2)n1CC Show InChI InChI=1S/C23H27N5O2S/c1-4-20(29)17-11-13-19(14-12-17)27(3)22(30)16-31-23-26-25-21(28(23)5-2)15-24-18-9-7-6-8-10-18/h6-14,24H,4-5,15-16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of mouse recombinant FATP1 acyl-coA synthetase activity using [14C]oleic acid as substrate				Bioorg Med Chem Lett 22: 5067-70 (2012) Article DOI: 10.1016/j.bmcl.2012.05.130 BindingDB Entry DOI: 10.7270/Q2VD70HW
					More data for this Ligand-Target Pair