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BDBM50385148 CHEMBL2035648

SMILES: COc1ccccc1N1CCN(CC1)C(=O)c1ccc[nH]1

InChI Key: InChIKey=LYMXWAQYQFPPMI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50385148   
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
Prostaglandin D Synthase


(Homo sapiens (Human))
BDBM50385148
PNG
(CHEMBL2035648)
Show SMILES COc1ccccc1N1CCN(CC1)C(=O)c1ccc[nH]1
Show InChI InChI=1S/C16H19N3O2/c1-21-15-7-3-2-6-14(15)18-9-11-19(12-10-18)16(20)13-5-4-8-17-13/h2-8,17H,9-12H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.90E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of HPGDS


Bioorg Med Chem Lett 22: 3795-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.004
BindingDB Entry DOI: 10.7270/Q28C9X82
More data for this
Ligand-Target Pair