BDBM350867 US9795608, Compound 1

SMILES: Nc1ncnc2c(nn(-c3ccc(Oc4cccc(OCc5cncs5)c4)cc3)c12)C1CCCC1

InChI Key: InChIKey=PJJZLEQLHQPWIV-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 = 350867   

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))	BDBM350867 (US9795608, Compound 1) Show SMILES Nc1ncnc2c(nn(-c3ccc(Oc4cccc(OCc5cncs5)c4)cc3)c12)C1CCCC1 Show InChI InChI=1S/C26H24N6O2S/c27-26-25-24(29-15-30-26)23(17-4-1-2-5-17)31-32(25)18-8-10-19(11-9-18)34-21-7-3-6-20(12-21)33-14-22-13-28-16-35-22/h3,6-13,15-17H,1-2,4-5,14H2,(H2,27,29,30)	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 US9795608 (2017) BindingDB Entry DOI: 10.7270/Q29K4DCP
					More data for this Ligand-Target Pair