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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 = 'BDBM192138'   
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))
BDBM192138
PNG
(US9187437, 4)
Show SMILES FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1noc(CCC2(CCCCC2)c2ccccc2)n1
Show InChI InChI=1S/C24H22F6N2O/c25-23(26,27)18-13-16(14-19(15-18)24(28,29)30)21-31-20(33-32-21)9-12-22(10-5-2-6-11-22)17-7-3-1-4-8-17/h1,3-4,7-8,13-15H,2,5-6,9-12H2
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Similars

US Patent
n/an/an/an/a 280n/an/an/a60



BRISTOL-MYERS SQUIBB COMPANY

US Patent


Assay Description
Compounds were loaded in a 384 Falcon v-bottom plate (0.5 ul/well in a 11 point, 3-fold dilution). Membranes prepared from S1P1/CHO cells or EDG3-G...


US Patent US9187437 (2015)


BindingDB Entry DOI: 10.7270/Q2JH3K0X
More data for this
Ligand-Target Pair