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BDBM176771 US9675612, 14 1-(3-Hydroxy-3-methylazetidin-1-yl)-3-[7-(1H-indazol-5-ylamino)[1,3]thiazolo[5,4-d]pyrimidin-2-yl]propan-1-one

SMILES: CC1(O)CN(C1)C(=O)CCc1nc2c(Nc3ccc4[nH]ncc4c3)ncnc2s1

InChI Key: InChIKey=ZOAUVUPYVLBWMI-UHFFFAOYSA-N

Data: 1 IC50

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 = 176771   
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
MAP kinase-interacting serine/threonine-protein kinase 1 (T344D)


(Homo sapiens (Human))
BDBM176771
PNG
(US9675612, 14 1-(3-Hydroxy-3-methylazetidin-1-yl)-...)
Show SMILES CC1(O)CN(C1)C(=O)CCc1nc2c(Nc3ccc4[nH]ncc4c3)ncnc2s1
Show InChI InChI=1S/C19H19N7O2S/c1-19(28)8-26(9-19)15(27)5-4-14-24-16-17(20-10-21-18(16)29-14)23-12-2-3-13-11(6-12)7-22-25-13/h2-3,6-7,10,28H,4-5,8-9H2,1H3,(H,22,25)(H,20,21,23)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 126n/an/an/an/a7.5n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


US Patent US9675612 (2017)


BindingDB Entry DOI: 10.7270/Q2RN3612
More data for this
Ligand-Target Pair