BDBM351788 US9796716, Compound 32

SMILES: Nc1ncnc2n(nc(-c3ccc(Oc4cccc(COc5ccccc5C(F)(F)F)c4)cc3)c12)C1CCCC1

InChI Key: InChIKey=OGAYHNSLJZXIKA-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 = 351788   

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))	BDBM351788 (US9796716, Compound 32) Show SMILES Nc1ncnc2n(nc(-c3ccc(Oc4cccc(COc5ccccc5C(F)(F)F)c4)cc3)c12)C1CCCC1 Show InChI InChI=1S/C30H26F3N5O2/c31-30(32,33)24-10-3-4-11-25(24)39-17-19-6-5-9-23(16-19)40-22-14-12-20(13-15-22)27-26-28(34)35-18-36-29(26)38(37-27)21-7-1-2-8-21/h3-6,9-16,18,21H,1-2,7-8,17H2,(H2,34,35,36)	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
					More data for this Ligand-Target Pair