Found 4 hits Enz. Inhib. hit(s) with all data for entry = 50046687 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Sphingosine kinase 2
(Homo sapiens (Human)) | BDBM50443388
(CHEMBL3086782 | US9688668, SLR080811)Show SMILES CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r| Show InChI InChI=1S/C21H31N5O/c1-2-3-4-5-6-7-9-16-11-13-17(14-12-16)19-24-20(27-25-19)18-10-8-15-26(18)21(22)23/h11-14,18H,2-10,15H2,1H3,(H3,22,23)/t18-/m0/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Tech
Curated by ChEMBL
| Assay Description
Inhibition of SphK2 (unknown origin) |
Bioorg Med Chem Lett 25: 4956-60 (2015)
Article DOI: 10.1016/j.bmcl.2015.03.041
BindingDB Entry DOI: 10.7270/Q28G8NHJ |
More data for this
Ligand-Target Pair | |
Sphingosine kinase 2
(Homo sapiens (Human)) | BDBM50017016
(CHEMBL3287036)Show InChI InChI=1S/C18H24N2O3S/c1-2-3-13-23-15-9-7-14(8-10-15)5-4-6-16-17(21)20(12-11-19)18(22)24-16/h6-10H,2-5,11-13,19H2,1H3/b16-6- | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Tech
Curated by ChEMBL
| Assay Description
Inhibition of SphK2 (unknown origin) |
Bioorg Med Chem Lett 25: 4956-60 (2015)
Article DOI: 10.1016/j.bmcl.2015.03.041
BindingDB Entry DOI: 10.7270/Q28G8NHJ |
More data for this
Ligand-Target Pair | |
Sphingosine kinase 2
(Homo sapiens (Human)) | BDBM50393642
(CHEMBL2158685)Show SMILES Clc1ccc(cc1)C12CC3CC(CC(C3)(C1)C(=O)NCc1ccncc1)C2 |TLB:14:9:26:15.13.12,14:13:8.9.10:26,THB:16:13:8:10.11.26,16:13:8.9.10:26,12:13:8:10.11.26,12:11:8:15.14.13| Show InChI InChI=1S/C23H25ClN2O/c24-20-3-1-19(2-4-20)22-10-17-9-18(11-22)13-23(12-17,15-22)21(27)26-14-16-5-7-25-8-6-16/h1-8,17-18H,9-15H2,(H,26,27) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Tech
Curated by ChEMBL
| Assay Description
Inhibition of SphK2 (unknown origin) |
Bioorg Med Chem Lett 25: 4956-60 (2015)
Article DOI: 10.1016/j.bmcl.2015.03.041
BindingDB Entry DOI: 10.7270/Q28G8NHJ |
More data for this
Ligand-Target Pair | |
Sphingosine kinase 1
(Homo sapiens (Human)) | BDBM50443388
(CHEMBL3086782 | US9688668, SLR080811)Show SMILES CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r| Show InChI InChI=1S/C21H31N5O/c1-2-3-4-5-6-7-9-16-11-13-17(14-12-16)19-24-20(27-25-19)18-10-8-15-26(18)21(22)23/h11-14,18H,2-10,15H2,1H3,(H3,22,23)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Tech
Curated by ChEMBL
| Assay Description
Inhibition of SphK1 (unknown origin) |
Bioorg Med Chem Lett 25: 4956-60 (2015)
Article DOI: 10.1016/j.bmcl.2015.03.041
BindingDB Entry DOI: 10.7270/Q28G8NHJ |
More data for this
Ligand-Target Pair | |
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