BDBM50089531 CHEMBL3578223

SMILES: COC(Cn1nc(-c2ccccc2)c2c(N)nc(SC)nc12)c1ccccc1

InChI Key: InChIKey=DGZMKJMPNOAZTM-UHFFFAOYSA-N

Data: 1 KI

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 = 50089531   

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
Tyrosine-protein kinase Fyn (Homo sapiens (Human))	BDBM50089531 (CHEMBL3578223) Show SMILES COC(Cn1nc(-c2ccccc2)c2c(N)nc(SC)nc12)c1ccccc1 Show InChI InChI=1S/C21H21N5OS/c1-27-16(14-9-5-3-6-10-14)13-26-20-17(19(22)23-21(24-20)28-2)18(25-26)15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3,(H2,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant full-length Fyn using Src substrate peptide after 15 mins incubation by MicroBeta liquid scintillation counting analy...				J Med Chem 58: 4590-609 (2015) Article DOI: 10.1021/acs.jmedchem.5b00140 BindingDB Entry DOI: 10.7270/Q29025HZ
					More data for this Ligand-Target Pair