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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50016674   
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
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50016674
PNG
(4-[Hydroxy-(4-phenyl-butyryl)-amino]-butyric acid ...)
Show SMILES CCOC(=O)CCCN(O)C(=O)CCCc1ccccc1
Show InChI InChI=1S/C16H23NO4/c1-2-21-16(19)12-7-13-17(20)15(18)11-6-10-14-8-4-3-5-9-14/h3-5,8-9,20H,2,6-7,10-13H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 300n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
In vitro inhibition of rat polymorphonuclear leukocyte 5-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016674
PNG
(4-[Hydroxy-(4-phenyl-butyryl)-amino]-butyric acid ...)
Show SMILES CCOC(=O)CCCN(O)C(=O)CCCc1ccccc1
Show InChI InChI=1S/C16H23NO4/c1-2-21-16(19)12-7-13-17(20)15(18)11-6-10-14-8-4-3-5-9-14/h3-5,8-9,20H,2,6-7,10-13H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 500n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibition of polymorphonuclear leukocyte derived human 5-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15


(Rattus norvegicus)
BDBM50016674
PNG
(4-[Hydroxy-(4-phenyl-butyryl)-amino]-butyric acid ...)
Show SMILES CCOC(=O)CCCN(O)C(=O)CCCc1ccccc1
Show InChI InChI=1S/C16H23NO4/c1-2-21-16(19)12-7-13-17(20)15(18)11-6-10-14-8-4-3-5-9-14/h3-5,8-9,20H,2,6-7,10-13H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibition of rat platelet 12-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair