BDBM352196 3-{4-[5-Amino-4-(6- morpholin-4-ylmethyl-1H- indole-2-carbonyl)-pyrazol- 1-yl]-3-chloro-phenoxy}- benzonitrile::US9802920, Compound I-20

SMILES: NCc1cccc(Oc2ccc(c(Cl)c2)-n2ncc(C(=O)c3cc4ccc(CN5CCOCC5)cc4[nH]3)c2N)c1

InChI Key: InChIKey=XLSVPGNFNKEVJA-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 352196   

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
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM352196 (3-{4-[5-Amino-4-(6- morpholin-4-ylmethyl-1H- indol...) Show SMILES NCc1cccc(Oc2ccc(c(Cl)c2)-n2ncc(C(=O)c3cc4ccc(CN5CCOCC5)cc4[nH]3)c2N)c1 Show InChI InChI=1S/C30H29ClN6O3/c31-25-15-23(40-22-3-1-2-19(12-22)16-32)6-7-28(25)37-30(33)24(17-34-37)29(38)27-14-21-5-4-20(13-26(21)35-27)18-36-8-10-39-11-9-36/h1-7,12-15,17,35H,8-11,16,18,32-33H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Hoffman-La Roche Inc.; Chugai Pharamceutical Co. US Patent					Assay Description This BTK competition assay measures compound potency (IC50) for the inactivated state of Bruton's Tyrosine Kinase using FRET (Förster/Flouresence...				US Patent US9802920 (2017) BindingDB Entry DOI: 10.7270/Q29G5PXH
					More data for this Ligand-Target Pair