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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 511.0
BDBM50281856

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50281856
PNG
(CHEMBL275823 | Sodium; (2R,6R)-6-{3-[(E)-2-(7-chlo...)
Show SMILES C[C@H](CCC[C@@H](SCCC(C)(C)O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C29H34ClNO3S/c1-20(28(32)33)6-4-9-27(35-17-16-29(2,3)34)23-8-5-7-21(18-23)10-14-25-15-12-22-11-13-24(30)19-26(22)31-25/h5,7-8,10-15,18-20,27,34H,4,6,9,16-17H2,1-3H3,(H,32,33)/p-1/b14-10+/t20-,27-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 0.800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-LTD4 binding to guinea-pig lung membrane


Bioorg Med Chem Lett 3: 1125-1130 (1993)


Article DOI: 10.1016/S0960-894X(00)80300-5
BindingDB Entry DOI: 10.7270/Q2VM4C6B
More data for this
Ligand-Target Pair