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Compile Data Set for Download or QSAR

Found 2 hits of ec50 for monomerid = 50361885   
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))
BDBM50361885
PNG
(CHEMBL1938931)
Show SMILES OC(=O)C1CN(Cc2ccc(-c3nc4ccc(cc4s3)C(=O)N3CCCC3)c(F)c2)C1
Show InChI InChI=1S/C23H22FN3O3S/c24-18-9-14(11-26-12-16(13-26)23(29)30)3-5-17(18)21-25-19-6-4-15(10-20(19)31-21)22(28)27-7-1-2-8-27/h3-6,9-10,16H,1-2,7-8,11-13H2,(H,29,30)
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PC cid
PC sid
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Article
PubMed
n/an/an/an/a>2.00E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human S1P1 receptor expressed in U20S cells coexpressing eGFP assessed as receptor internalization after 1 hr by microscopy analy...


Bioorg Med Chem Lett 22: 628-33 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.069
BindingDB Entry DOI: 10.7270/Q2T72HW3
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50361885
PNG
(CHEMBL1938931)
Show SMILES OC(=O)C1CN(Cc2ccc(-c3nc4ccc(cc4s3)C(=O)N3CCCC3)c(F)c2)C1
Show InChI InChI=1S/C23H22FN3O3S/c24-18-9-14(11-26-12-16(13-26)23(29)30)3-5-17(18)21-25-19-6-4-15(10-20(19)31-21)22(28)27-7-1-2-8-27/h3-6,9-10,16H,1-2,7-8,11-13H2,(H,29,30)
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PC sid
UniChem

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Article
PubMed
n/an/an/an/a>2.50E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human S1P3 receptor expressed in CHO cells coexpressing Gq/i5 protein by calcium flux assay


Bioorg Med Chem Lett 22: 628-33 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.069
BindingDB Entry DOI: 10.7270/Q2T72HW3
More data for this
Ligand-Target Pair