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SMILES: Cc1cc(O[C@H]2CC[C@@H](CC2)C(C)(C)C)c(CN2CCC(CC(O)=O)C2)c2ccccc12

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50559618   
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
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))		BDBM50559618
PNG
(CHEMBL4744455)
Show SMILES Cc1cc(O[C@H]2CC[C@@H](CC2)C(C)(C)C)c(CN2CCC(CC(O)=O)C2)c2ccccc12 |r,wU:8.11,wD:5.4,(11.28,-6.95,;11.28,-8.49,;9.95,-9.26,;9.95,-10.81,;8.62,-11.58,;7.28,-10.81,;7.29,-9.26,;5.97,-8.49,;4.63,-9.25,;4.62,-10.79,;5.96,-11.57,;3.3,-8.47,;3.3,-6.93,;1.96,-9.24,;1.95,-7.7,;11.28,-11.58,;11.29,-13.12,;12.62,-13.88,;12.79,-15.42,;14.3,-15.73,;15.06,-14.4,;16.6,-14.23,;17.5,-15.48,;19.03,-15.31,;16.88,-16.88,;14.03,-13.25,;12.62,-10.8,;13.95,-11.57,;15.29,-10.79,;15.28,-9.24,;13.94,-8.48,;12.62,-9.26,)|
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 3.70n/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant human S1P5 receptor expressed in Chem-1 cells assessed as EC80 S1P-induced calcium flux measured for 180 secs by F...

Citation and Details

Article DOI: 10.1021/acsmedchemlett.0c00631
BindingDB Entry DOI: 10.7270/Q2D79G4R
More data for this
Ligand-Target Pair