BDBM50238086 CHEMBL4078651

SMILES: COc1cccc2nccc(Nc3cc(ncc3C)-c3cccc(Cl)c3)c12

InChI Key: InChIKey=WREBEHZHELJORV-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50238086   

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))	BDBM50238086 (CHEMBL4078651) Show SMILES COc1cccc2nccc(Nc3cc(ncc3C)-c3cccc(Cl)c3)c12 Show InChI InChI=1S/C22H18ClN3O/c1-14-13-25-20(15-5-3-6-16(23)11-15)12-19(14)26-18-9-10-24-17-7-4-8-21(27-2)22(17)18/h3-13H,1-2H3,(H,24,25,26)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Takeda California Curated by ChEMBL					Assay Description Concentration required for 50% inhibition of Angiotensin I converting enzyme				Bioorg Med Chem Lett 27: 1955-1961 (2017) Article DOI: 10.1016/j.bmcl.2017.03.026 BindingDB Entry DOI: 10.7270/Q2QJ7KKZ
					More data for this Ligand-Target Pair