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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 1' and Ligand = 'BDBM183673'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM183673
PNG
(US9150519, 1-65)
Show SMILES Cc1cc(ccc1NC(=O)c1cc(OC2CCCCC2)ncn1)S(N)(=O)=O
Show InChI InChI=1S/C18H22N4O4S/c1-12-9-14(27(19,24)25)7-8-15(12)22-18(23)16-10-17(21-11-20-16)26-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,22,23)(H2,19,24,25)
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PC cid
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US Patent
n/an/an/an/a 1.33E+4n/an/a7.430



MERCK SERONO SA

US Patent


Assay Description
Measurements of 35S-GTPgammaS Binding: Membranes (1 to 10 µg protein) prepared as described above, were incubated in 96-well Scintiplates (PerkinElm...


US Patent US9150519 (2015)


BindingDB Entry DOI: 10.7270/Q2H993ZK
More data for this
Ligand-Target Pair