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BDBM50011648 1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one::CHEMBL282905

SMILES: Cc1nnc2CN=C(c3cc(sc3-n12)C#CCn1c2ccccc2n(C=C=C)c1=O)c1ccccc1Cl

InChI Key: InChIKey=XFGIDJJFLXZWNM-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011648   
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))
BDBM50011648
PNG
(1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8...)
Show SMILES Cc1nnc2CN=C(c3cc(sc3-n12)C#CCn1c2ccccc2n(C=C=C)c1=O)c1ccccc1Cl |c:6|
Show InChI InChI=1S/C28H19ClN6OS/c1-3-14-33-23-12-6-7-13-24(23)34(28(33)36)15-8-9-19-16-21-26(20-10-4-5-11-22(20)29)30-17-25-32-31-18(2)35(25)27(21)37-19/h4-7,10-14,16H,1,15,17H2,2H3
PDB

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PC cid
PC sid
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n/an/a 6n/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