BDBM50313598 (E)-5-(2-(6-((4-(2-hydroxyethyl)piperazin-1-yl)methyl)pyridin-2-yl)vinyl)-4-(4-methyl-1H-indol-5-ylamino)nicotinonitrile::CHEMBL1091481

SMILES: Cc1c(Nc2c(\C=C\c3cccc(CN4CCN(CCO)CC4)n3)cncc2C#N)ccc2[nH]ccc12

InChI Key: InChIKey=WUJFWMRQXPIJIN-AATRIKPKSA-N

Data: 2 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 2 hits for monomerid = 50313598   

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
Protein kinase C delta type (Homo sapiens (Human))	BDBM50313598 ((E)-5-(2-(6-((4-(2-hydroxyethyl)piperazin-1-yl)met...) Show SMILES Cc1c(Nc2c(\C=C\c3cccc(CN4CCN(CCO)CC4)n3)cncc2C#N)ccc2[nH]ccc12 Show InChI InChI=1S/C29H31N7O/c1-21-26-9-10-32-28(26)8-7-27(21)34-29-22(18-31-19-23(29)17-30)5-6-24-3-2-4-25(33-24)20-36-13-11-35(12-14-36)15-16-37/h2-10,18-19,32,37H,11-16,20H2,1H3,(H,31,34)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PKCdelta				Bioorg Med Chem Lett 20: 1965-8 (2010) Article DOI: 10.1016/j.bmcl.2010.01.119 BindingDB Entry DOI: 10.7270/Q2H70FX5
					More data for this Ligand-Target Pair
Protein kinase C theta type (Homo sapiens (Human))	BDBM50313598 ((E)-5-(2-(6-((4-(2-hydroxyethyl)piperazin-1-yl)met...) Show SMILES Cc1c(Nc2c(\C=C\c3cccc(CN4CCN(CCO)CC4)n3)cncc2C#N)ccc2[nH]ccc12 Show InChI InChI=1S/C29H31N7O/c1-21-26-9-10-32-28(26)8-7-27(21)34-29-22(18-31-19-23(29)17-30)5-6-24-3-2-4-25(33-24)20-36-13-11-35(12-14-36)15-16-37/h2-10,18-19,32,37H,11-16,20H2,1H3,(H,31,34)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.650	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PKCtheta				Bioorg Med Chem Lett 20: 1965-8 (2010) Article DOI: 10.1016/j.bmcl.2010.01.119 BindingDB Entry DOI: 10.7270/Q2H70FX5
					More data for this Ligand-Target Pair