null

SMILES: CCCc1ccnc(NC(=O)c2ccc(-c3nc([C@H]4CC[C@H](O)CC4)n4ccnc(N)c34)c(C)c2)c1

InChI Key: InChIKey=BOWGLJZQGRTCGX-XUTJKUGGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 267480   

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))	BDBM267480 (4-(8-amino-3-((trans)-4-hydroxycyclohexyl)imidazo[...) Show SMILES CCCc1ccnc(NC(=O)c2ccc(-c3nc([C@H]4CC[C@H](O)CC4)n4ccnc(N)c34)c(C)c2)c1 |r,wU:18.17,wD:21.21,(-1.49,10.32,;-.4,9.23,;1.08,9.63,;2.17,8.54,;3.66,8.94,;4.75,7.85,;4.35,6.36,;2.86,5.96,;2.46,4.47,;.98,4.08,;-.11,5.16,;.58,2.59,;-.91,2.19,;-1.31,.7,;-.22,-.39,;-.62,-1.88,;.29,-3.12,;-.62,-4.37,;-.22,-5.85,;1.27,-6.25,;1.67,-7.74,;.58,-8.83,;.98,-10.32,;-.91,-8.43,;-1.31,-6.94,;-2.08,-3.89,;-3.42,-4.66,;-4.75,-3.89,;-4.75,-2.35,;-3.42,-1.58,;-3.42,-.04,;-2.08,-2.35,;1.27,.01,;2.36,-1.08,;1.67,1.5,;1.77,7.05,)| Show InChI InChI=1S/C28H32N6O2/c1-3-4-18-11-12-30-23(16-18)32-28(36)20-7-10-22(17(2)15-20)24-25-26(29)31-13-14-34(25)27(33-24)19-5-8-21(35)9-6-19/h7,10-16,19,21,35H,3-6,8-9H2,1-2H3,(H2,29,31)(H,30,32,36)/t19-,21-	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
					More data for this Ligand-Target Pair