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BDBM329429 2-((1S,2S)-2-((2- methyl-5-(6- methylpyridin-3- yl)pyrimidin-4- yloxy)methyl)cyclopropyl) quinoline::US9663513, 42

SMILES: Cc1ccc(cn1)-c1cnc(C)nc1OC[C@H]1C[C@@H]1c1ccc2ccccc2n1

InChI Key: InChIKey=YBXGSIKKJZRKIG-UXHICEINSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 329429   
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
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM329429
PNG
(2-((1S,2S)-2-((2- methyl-5-(6- methylpyridin-3- yl...)
Show SMILES Cc1ccc(cn1)-c1cnc(C)nc1OC[C@H]1C[C@@H]1c1ccc2ccccc2n1
Show InChI InChI=1S/C24H22N4O/c1-15-7-8-18(12-25-15)21-13-26-16(2)27-24(21)29-14-19-11-20(19)23-10-9-17-5-3-4-6-22(17)28-23/h3-10,12-13,19-20H,11,14H2,1-2H3/t19-,20+/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
0.0200n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The fluorescence polarization assay for cyclic nucleotide phosphodiesterases was performed using an IMAP® FP kit supplied by Molecular Devices, Sunny...


US Patent US9663513 (2017)

More data for this
Ligand-Target Pair