BDBM316492 US9630931, Example 1

SMILES COc1cc(CCNCC2CCNCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

InChI Key InChIKey=QTVRATOTAKVKRR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 316492   

TargetSerine/threonine-protein kinase Chk1(Homo sapiens (Human))
Sentinel Oncology

US Patent
LigandPNGBDBM316492(US9630931, Example 1)
Affinity DataIC50:  0.100nMAssay Description:Reaction Buffer:Base Reaction buffer: 20 mM Hepes (pH 7.5), 10 mM MgCl2, 1 mM EGTA, 0.02% Brij35, 0.02 mg/ml BSA, 0.1 mM Na3VO4, 2 mM DTT, 1% DMSOReq...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent