BDBM245210 US9428500, 4

SMILES: CN1CCN(CC1)c1ccc(cn1)-c1ccc2[nH]c3nccc(\C=C\c4ccccc4)c3c2c1

InChI Key: InChIKey=RKRPACLXIUKWJB-BQYQJAHWSA-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 = 245210   

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
ALK tyrosine kinase receptor (L1196M) (Homo sapiens (Human))	BDBM245210 (US9428500, 4) Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1ccc2[nH]c3nccc(\C=C\c4ccccc4)c3c2c1 Show InChI InChI=1S/C29H27N5/c1-33-15-17-34(18-16-33)27-12-10-24(20-31-27)23-9-11-26-25(19-23)28-22(13-14-30-29(28)32-26)8-7-21-5-3-2-4-6-21/h2-14,19-20H,15-18H2,1H3,(H,30,32)/b8-7+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	350	n/a	n/a	n/a	n/a	7.5	30
UNIVERSITA DEGLI STUDI DI MILANO—BICOCCA; UNIVERSITE DE GENEVE; UNIVERSITE CLAUDE BERNARD—LYON US Patent					Assay Description GST-tagged recombinant wild-type or L1196M mutated ALK kinase (rALK) was expressed in Sf9 insect cells using the pBacPAK baculovirus vector system (C...				US Patent US9428500 (2016) BindingDB Entry DOI: 10.7270/Q2CR5S8M
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM245210 (US9428500, 4) Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1ccc2[nH]c3nccc(\C=C\c4ccccc4)c3c2c1 Show InChI InChI=1S/C29H27N5/c1-33-15-17-34(18-16-33)27-12-10-24(20-31-27)23-9-11-26-25(19-23)28-22(13-14-30-29(28)32-26)8-7-21-5-3-2-4-6-21/h2-14,19-20H,15-18H2,1H3,(H,30,32)/b8-7+	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	350	n/a	n/a	n/a	n/a	7.5	30
UNIVERSITA DEGLI STUDI DI MILANO—BICOCCA; UNIVERSITE DE GENEVE; UNIVERSITE CLAUDE BERNARD—LYON US Patent					Assay Description GST-tagged recombinant wild-type or L1196M mutated ALK kinase (rALK) was expressed in Sf9 insect cells using the pBacPAK baculovirus vector system (C...				US Patent US9428500 (2016) BindingDB Entry DOI: 10.7270/Q2CR5S8M
					More data for this Ligand-Target Pair