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BDBM50088244 7-[3-(2-Cyclopropylmethyl-3-methoxymethyl-4-thiazol-4-yl-phenoxy)-propoxy]-8-propyl-chroman-2-carboxylic acid::CHEMBL58495

SMILES: CCCc1c(OCCCOc2ccc(-c3cscn3)c(COC)c2CC2CC2)ccc2CC[C@@H](Oc12)C(O)=O

InChI Key: InChIKey=PRRASNJIAWFDAA-GDLZYMKVSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50088244   
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
LTB4R


(HUMAN)
BDBM50088244
PNG
(7-[3-(2-Cyclopropylmethyl-3-methoxymethyl-4-thiazo...)
Show SMILES CCCc1c(OCCCOc2ccc(-c3cscn3)c(COC)c2CC2CC2)ccc2CC[C@@H](Oc12)C(O)=O
Show InChI InChI=1S/C31H37NO6S/c1-3-5-23-27(11-8-21-9-12-29(31(33)34)38-30(21)23)36-14-4-15-37-28-13-10-22(26-18-39-19-32-26)25(17-35-2)24(28)16-20-6-7-20/h8,10-11,13,18-20,29H,3-7,9,12,14-17H2,1-2H3,(H,33,34)/t29-/m1/s1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.20n/an/an/an/an/an/an/an/a



NeoGenesis, Inc.

Curated by ChEMBL


Assay Description
Binding affinity to leukotriene B4 receptor


J Med Chem 43: 1993-2006 (2000)


Article DOI: 10.1021/jm990504b
BindingDB Entry DOI: 10.7270/Q2MP53ZS
More data for this
Ligand-Target Pair