BDBM50387681 CHEMBL2058346

SMILES: CCn1c(CNc2ccccc2)nnc1SCc1nc2cc(ccc2o1)C(=O)C(C)C

InChI Key: InChIKey=GXWZYUDVRIKHLF-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 = 50387681   

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))	BDBM50387681 (CHEMBL2058346) Show SMILES CCn1c(CNc2ccccc2)nnc1SCc1nc2cc(ccc2o1)C(=O)C(C)C Show InChI InChI=1S/C23H25N5O2S/c1-4-28-20(13-24-17-8-6-5-7-9-17)26-27-23(28)31-14-21-25-18-12-16(22(29)15(2)3)10-11-19(18)30-21/h5-12,15,24H,4,13-14H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	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)	BDBM50387681 (CHEMBL2058346) Show SMILES CCn1c(CNc2ccccc2)nnc1SCc1nc2cc(ccc2o1)C(=O)C(C)C Show InChI InChI=1S/C23H25N5O2S/c1-4-28-20(13-24-17-8-6-5-7-9-17)26-27-23(28)31-14-21-25-18-12-16(22(29)15(2)3)10-11-19(18)30-21/h5-12,15,24H,4,13-14H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	520	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