BDBM351879 US9796716, Compound 124

SMILES: Cc1ncc(COc2cc(F)cc(Oc3ccc(cc3)-c3nn(CC4(C)COC4)c4ncnc(N)c34)c2)n1C

InChI Key: InChIKey=RSPKQOZBJJWTFH-UHFFFAOYSA-N

Data: 1 KI

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 = 351879   

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))	BDBM351879 (US9796716, Compound 124) Show SMILES Cc1ncc(COc2cc(F)cc(Oc3ccc(cc3)-c3nn(CC4(C)COC4)c4ncnc(N)c34)c2)n1C Show InChI InChI=1S/C28H28FN7O3/c1-17-31-11-20(35(17)3)12-38-22-8-19(29)9-23(10-22)39-21-6-4-18(5-7-21)25-24-26(30)32-16-33-27(24)36(34-25)13-28(2)14-37-15-28/h4-11,16H,12-15H2,1-3H3,(H2,30,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
PHARMASCIENCE, INC. US Patent					Assay Description Fluorescence polarization-based kinase assays were performed in 384 well-plate format using histidine tagged recombinant human full-length Bruton Aga...				US Patent US9796716 (2017) BindingDB Entry DOI: 10.7270/Q2MW2K8J
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