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BDBM205243 US9249123, 127

SMILES: CN1CCN(C)C(=O)C1c1ccc(Nc2nc(cn(C)c2=O)-c2cccc(N3Cc4cc(ccc4C3=O)C(C)(C)C)c2C)cc1

InChI Key: InChIKey=DICBIERJIHQSTA-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 205243   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM205243
PNG
(US9249123, 127)
Show SMILES CN1CCN(C)C(=O)C1c1ccc(Nc2nc(cn(C)c2=O)-c2cccc(N3Cc4cc(ccc4C3=O)C(C)(C)C)c2C)cc1
Show InChI InChI=1/C36H40N6O3/c1-22-27(9-8-10-30(22)42-20-24-19-25(36(2,3)4)13-16-28(24)33(42)43)29-21-41(7)35(45)32(38-29)37-26-14-11-23(12-15-26)31-34(44)40(6)18-17-39(31)5/h8-16,19,21,31H,17-18,20H2,1-7H3,(H,37,38)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 29.4n/an/an/an/a7.5n/a



Genentech Inc

US Patent


Assay Description
A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds is as follows. A master mix minus Bt...


US Patent US9249123 (2016)


BindingDB Entry DOI: 10.7270/Q2HD7TG8
More data for this
Ligand-Target Pair