BDBM50186358 CHEMBL377463::N-(3-(5-(4-(piperidin-1-yl)piperidin-1-yl)-1H-benzo[d]imidazol-2-yl)-1H-indazol-5-yl)furan-2-carboxamide

SMILES: O=C(Nc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1)c1ccco1

InChI Key: InChIKey=USCJBUZPUNRXEU-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50186358   

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
Bcr-Abl (Homo sapiens (Human))	BDBM50186358 (CHEMBL377463 | N-(3-(5-(4-(piperidin-1-yl)piperidi...) Show SMILES O=C(Nc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1)c1ccco1 Show InChI InChI=1S/C29H31N7O2/c37-29(26-5-4-16-38-26)30-19-6-8-23-22(17-19)27(34-33-23)28-31-24-9-7-21(18-25(24)32-28)36-14-10-20(11-15-36)35-12-2-1-3-13-35/h4-9,16-18,20H,1-3,10-15H2,(H,30,37)(H,31,32)(H,33,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	560	n/a	n/a	n/a	n/a
Chiron Corporation Curated by ChEMBL					Assay Description Antiproliferative activity against K562 cells expressing Bcr-Abl				Bioorg Med Chem Lett 16: 3789-92 (2006) Article DOI: 10.1016/j.bmcl.2006.04.043 BindingDB Entry DOI: 10.7270/Q2HD7WG3
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50186358 (CHEMBL377463 | N-(3-(5-(4-(piperidin-1-yl)piperidi...) Show SMILES O=C(Nc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1)c1ccco1 Show InChI InChI=1S/C29H31N7O2/c37-29(26-5-4-16-38-26)30-19-6-8-23-22(17-19)27(34-33-23)28-31-24-9-7-21(18-25(24)32-28)36-14-10-20(11-15-36)35-12-2-1-3-13-35/h4-9,16-18,20H,1-3,10-15H2,(H,30,37)(H,31,32)(H,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Chiron Corporation Curated by ChEMBL					Assay Description Inhibition of c-ABL				Bioorg Med Chem Lett 16: 3789-92 (2006) Article DOI: 10.1016/j.bmcl.2006.04.043 BindingDB Entry DOI: 10.7270/Q2HD7WG3
					More data for this Ligand-Target Pair