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BDBM50011649 4-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-7-fluoro-4H-benzo[1,4]oxazin-3-one::CHEMBL20418

SMILES: Cc1nnc2CN=C(c3cc(sc3-n12)C#CCN1C(=O)COc2cc(F)ccc12)c1ccccc1Cl

InChI Key: InChIKey=SLQSJPDLBGHABB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011649   
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))
BDBM50011649
PNG
(4-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8...)
Show SMILES Cc1nnc2CN=C(c3cc(sc3-n12)C#CCN1C(=O)COc2cc(F)ccc12)c1ccccc1Cl |c:6|
Show InChI InChI=1S/C26H17ClFN5O2S/c1-15-30-31-23-13-29-25(18-6-2-3-7-20(18)27)19-12-17(36-26(19)33(15)23)5-4-10-32-21-9-8-16(28)11-22(21)35-14-24(32)34/h2-3,6-9,11-12H,10,13-14H2,1H3
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n/an/a 4n/an/an/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
PAF-antagonist activity determined in dog platelets by PAF-binding assay


J Med Chem 34: 1209-21 (1991)


BindingDB Entry DOI: 10.7270/Q23X85M1
More data for this
Ligand-Target Pair