BDBM50402152 CHEMBL2208003

SMILES: Cc1csc(n1)-c1[nH]c(CN2CCCC2=O)nc1-c1ccc2ncsc2c1

InChI Key: InChIKey=NEBUGKXURNWOSC-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 = 50402152   

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
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50402152 (CHEMBL2208003) Show SMILES Cc1csc(n1)-c1[nH]c(CN2CCCC2=O)nc1-c1ccc2ncsc2c1 Show InChI InChI=1S/C19H17N5OS2/c1-11-9-26-19(21-11)18-17(12-4-5-13-14(7-12)27-10-20-13)22-15(23-18)8-24-6-2-3-16(24)25/h4-5,7,9-10H,2-3,6,8H2,1H3,(H,22,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human ALK5 using GST-tagged Smad3 as substrate assessed as substrate phosphorylation after 30 mins by ELISA				Bioorg Med Chem 20: 7128-38 (2012) Article DOI: 10.1016/j.bmc.2012.09.066 BindingDB Entry DOI: 10.7270/Q2542PQ0
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50402152 (CHEMBL2208003) Show SMILES Cc1csc(n1)-c1[nH]c(CN2CCCC2=O)nc1-c1ccc2ncsc2c1 Show InChI InChI=1S/C19H17N5OS2/c1-11-9-26-19(21-11)18-17(12-4-5-13-14(7-12)27-10-20-13)22-15(23-18)8-24-6-2-3-16(24)25/h4-5,7,9-10H,2-3,6,8H2,1H3,(H,22,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of ALK5-mediated TNFalpha-induced Smad2/3 phosphorylation in human A549 cells preincubated for 2 hrs before addition of TNFalpha after 1 h...				Bioorg Med Chem 20: 7128-38 (2012) Article DOI: 10.1016/j.bmc.2012.09.066 BindingDB Entry DOI: 10.7270/Q2542PQ0
					More data for this Ligand-Target Pair