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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sphingosine-1-phosphate lyase 1' and Ligand = 'BDBM50187501'   
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
Sphingosine-1-phosphate lyase 1


(Rattus norvegicus)
BDBM50187501
PNG
(CHEMBL3827445)
Show SMILES CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)CP(O)(O)=O |r|
Show InChI InChI=1S/C18H40NO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24(21,22)23/h17-18,20H,2-16,19H2,1H3,(H2,21,22,23)/t17-,18+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
5.00E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Competitive inhibition of rat liver microsomal S1PL using varying levels of [3-3H]-D(+) erythro-sphinganine-1-phosphate as substrate incubated for 15...


Citation and Details

Article DOI: 10.1016/j.ejmech.2016.08.008
BindingDB Entry DOI: 10.7270/Q29W0K5N
More data for this
Ligand-Target Pair
Sphingosine-1-phosphate lyase 1


(Rattus norvegicus)
BDBM50187501
PNG
(CHEMBL3827445)
Show SMILES CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)CP(O)(O)=O |r|
Show InChI InChI=1S/C18H40NO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24(21,22)23/h17-18,20H,2-16,19H2,1H3,(H2,21,22,23)/t17-,18+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
5.00E+3n/an/an/an/an/an/an/an/a



Institute for Advanced Chemistry of Catalonia (IQAC-CSIC)

Curated by ChEMBL


Assay Description
Competitive inhibition of rat S1PL in presence of D(+)-erythro-sphinganine-1-phosphate measured after 15 mins by Dixon plot analysis


Bioorg Med Chem 24: 4381-4389 (2016)


Article DOI: 10.1016/j.bmc.2016.07.033
BindingDB Entry DOI: 10.7270/Q2862JDX
More data for this
Ligand-Target Pair