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BDBM50421410 CHEMBL2304166

SMILES: C[C@@H]1C(=O)O[C@H]2[C@H](OCOCc3ccccc3)C34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O

InChI Key: InChIKey=ATAYLENYWYIQNW-DZQZXAQMSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50421410   
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
Platelet activating factor receptor


(Homo sapiens (Human))
BDBM50421410
PNG
(CHEMBL2304166)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](OCOCc3ccccc3)C34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C28H32O11/c1-13-20(30)37-19-18(35-12-34-11-14-8-6-5-7-9-14)26-16-10-15(24(2,3)4)25(26)17(29)21(31)38-23(25)39-28(26,22(32)36-16)27(13,19)33/h5-9,13,15-19,23,29,33H,10-12H2,1-4H3/t13-,15+,16-,17+,18+,19+,23+,25+,26?,27-,28-/m1/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 59n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Compound was evaluated for anti-platelet activating factor potency


Bioorg Med Chem Lett 8: 1291-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VH5PB6
More data for this
Ligand-Target Pair