BDBM28411 (2E)-3-(3-{6-[(3-aminopropyl)amino]pyrazin-2-yl}phenyl)prop-2-enoic acid::pyrazine inhibitor, 14

SMILES: NCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1

InChI Key: InChIKey=PTWSEGPYHSUYPP-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 = 28411   

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))	BDBM28411 ((2E)-3-(3-{6-[(3-aminopropyl)amino]pyrazin-2-yl}ph...) Show SMILES NCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1 Show InChI InChI=1S/C16H18N4O2/c17-7-2-8-19-15-11-18-10-14(20-15)13-4-1-3-12(9-13)5-6-16(21)22/h1,3-6,9-11H,2,7-8,17H2,(H,19,20)(H,21,22)/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	27	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