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BDBM50281874 6-[3-(4-Acetyl-3-methoxy-2-propyl-phenoxy)-propoxy]-8-propyl-chroman-2-carboxylic acid::CHEMBL15817

SMILES: CCCc1cc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC)cc2CCC(Oc12)C(O)=O

InChI Key: InChIKey=DUJZETRWEYFSCU-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50281874   
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
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50281874
PNG
(6-[3-(4-Acetyl-3-methoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC)cc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C28H36O7/c1-5-8-19-16-21(17-20-10-12-25(28(30)31)35-26(19)20)33-14-7-15-34-24-13-11-22(18(3)29)27(32-4)23(24)9-6-2/h11,13,16-17,25H,5-10,12,14-15H2,1-4H3,(H,30,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
15n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against LTB4 receptor in guinea pig membrane


Bioorg Med Chem Lett 3: 1147-1152 (1993)


Article DOI: 10.1016/S0960-894X(00)80304-2
BindingDB Entry DOI: 10.7270/Q2M32VP9
More data for this
Ligand-Target Pair
LTB4R


(Homo sapiens (Human))
BDBM50281874
PNG
(6-[3-(4-Acetyl-3-methoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC)cc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C28H36O7/c1-5-8-19-16-21(17-20-10-12-25(28(30)31)35-26(19)20)33-14-7-15-34-24-13-11-22(18(3)29)27(32-4)23(24)9-6-2/h11,13,16-17,25H,5-10,12,14-15H2,1-4H3,(H,30,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 41n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition against LTB4 receptor in human neutrophil


Bioorg Med Chem Lett 3: 1147-1152 (1993)


Article DOI: 10.1016/S0960-894X(00)80304-2
BindingDB Entry DOI: 10.7270/Q2M32VP9
More data for this
Ligand-Target Pair