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BDBM50539039 CHEMBL4637898

SMILES: O[C@H](COC(=O)CCCCCCCCCCCCc1ccc(cc1)-c1ccccc1)COP(O)(O)=O

InChI Key: InChIKey=QNNZRALUDGVMSB-HHHXNRCGSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50539039   
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
Lysophosphatidic acid receptor 1


(Homo sapiens (Human))
BDBM50539039
PNG
(CHEMBL4637898)
Show SMILES O[C@H](COC(=O)CCCCCCCCCCCCc1ccc(cc1)-c1ccccc1)COP(O)(O)=O |r|
Show InChI InChI=1S/C28H41O7P/c29-27(23-35-36(31,32)33)22-34-28(30)17-13-8-6-4-2-1-3-5-7-10-14-24-18-20-26(21-19-24)25-15-11-9-12-16-25/h9,11-12,15-16,18-21,27,29H,1-8,10,13-14,17,22-23H2,(H2,31,32,33)/t27-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 1.90E+4n/an/an/an/a



Universidad Complutense de Madrid

Curated by ChEMBL


Assay Description
Agonist activity at LPA1 receptor (unknown origin) stably expressed in rat RH7777 cells assessed as increase in intracellular calcium level by Fluo-4...


J Med Chem 63: 2372-2390 (2020)

More data for this
Ligand-Target Pair