BDBM267511 4-(8-amino-3-((cis)-4-methoxycyclohexyl)imidazo [1,5-a]pyrazin-1-yl)-N-(5-ethylthiazol-2-yl)benzamide::US9718828, Example, 40

SMILES: CO[C@H]1CC[C@H](CC1)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12

InChI Key: InChIKey=ODFXQWSRLJZZIY-UWUNEBHHSA-N

Data: 1 EC50

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 = 267511   

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))	BDBM267511 (4-(8-amino-3-((cis)-4-methoxycyclohexyl)imidazo [1...) Show SMILES CO[C@H]1CC[C@H](CC1)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12 |r,wU:5.8,2.1,(-.11,-10.52,;.98,-9.43,;.58,-7.94,;-.91,-7.54,;-1.31,-6.05,;-.22,-4.96,;1.27,-5.36,;1.67,-6.85,;-.62,-3.48,;.29,-2.23,;-.62,-.99,;-.22,.5,;1.27,.9,;1.67,2.39,;.58,3.48,;-.91,3.08,;-1.31,1.59,;.98,4.96,;-.11,6.05,;2.46,5.36,;2.86,6.85,;1.77,7.94,;2.17,9.43,;3.66,9.83,;4.75,8.74,;4.35,7.25,;1.08,10.52,;-.4,10.12,;1.48,12,;.69,9.03,;-2.08,-1.46,;-3.42,-.69,;-3.42,.85,;-4.75,-1.46,;-4.75,-3,;-3.42,-3.77,;-2.08,-3,)| Show InChI InChI=1S/C26H25F3N6O2/c1-37-19-8-6-16(7-9-19)24-34-21(22-23(30)32-12-13-35(22)24)15-2-4-17(5-3-15)25(36)33-20-14-18(10-11-31-20)26(27,28)29/h2-5,10-14,16,19H,6-9H2,1H3,(H2,30,32)(H,31,33,36)/t16-,19+	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	n/a	n/a	<10	n/a	n/a	7.2	25
MERCK SHARP & DOHME CORP.; MERCK SHARP & DOHME B.V. US Patent					Assay Description Btk enzyme activity is measured using the IMAP (immobilized metal ion affinity-based fluorescence polarization) assay as outlined below. Btk enzyme (...				US Patent US9718828 (2017) BindingDB Entry DOI: 10.7270/Q2H9977T
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