BDBM28404 (2E)-3-{3-[6-(1,4-diazepan-1-yl)pyrazin-2-yl]phenyl}prop-2-enoic acid::pyrazine inhibitor, 7

SMILES: OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCCNCC1

InChI Key: InChIKey=BNLMRXUZCYLPPZ-AATRIKPKSA-N

Data: 1 IC50

PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 28404   

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
Serine/threonine-protein kinase pim-2 (Homo sapiens (Human))	BDBM28404 ((2E)-3-{3-[6-(1,4-diazepan-1-yl)pyrazin-2-yl]pheny...) Show SMILES OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCCNCC1 Show InChI InChI=1S/C18H20N4O2/c23-18(24)6-5-14-3-1-4-15(11-14)16-12-20-13-17(21-16)22-9-2-7-19-8-10-22/h1,3-6,11-13,19H,2,7-10H2,(H,23,24)/b6-5+	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	7.5	22
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description The activity of Pim kinase was measured in a homogeneous luciferase assay using GST-Pim, biotinylated peptide substrate and a luciferin-luciferase de...				J Med Chem 52: 1814-27 (2009) Article DOI: 10.1021/jm801242y BindingDB Entry DOI: 10.7270/Q25T3HS3
					More data for this Ligand-Target Pair