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1 similar compounds to monomer 50169060

Compile data set for download or QSAR
Wt: 426.3
BDBM50169053

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50169053   
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
P-selectin/P-selectin glycoprotein ligand 1


(Homo sapiens (Human))
BDBM50169053
PNG
((3R,5R)-3,4,5-Trihydroxy-1-(2'-trifluoromethyl-bip...)
Show SMILES O[C@@H]1C[C@](C[C@@H](O)[C@H]1O)(OCc1ccc(cc1)-c1ccccc1C(F)(F)F)C(O)=O
Show InChI InChI=1S/C21H21F3O6/c22-21(23,24)15-4-2-1-3-14(15)13-7-5-12(6-8-13)11-30-20(19(28)29)9-16(25)18(27)17(26)10-20/h1-8,16-18,25-27H,9-11H2,(H,28,29)/t16-,17-,18-,20+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+7n/an/an/an/an/an/a



Wyeth

Curated by ChEMBL


Assay Description
Inhibitory concentration against selectin P in Biacore assay


J Med Chem 48: 4346-57 (2005)


Article DOI: 10.1021/jm050049l
BindingDB Entry DOI: 10.7270/Q2W095GF
More data for this
Ligand-Target Pair