Home
Info
Download
About us
Email us
Contribute data
Web Services
Beta Site
myBDB
logout
Search and Browse
Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
Substrate or Competitor
Compound Mol. Wt.
Chemical Structure
Pathways
Source Organism
Number of Compounds
Monomer List in csv
Het List in SDF
Compound
FDA Drugs
Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
Special tools
3D Structure Series
Find My Compound's Targets
Find Compounds for My Targets
Do Virtual Screening
SCOP
Citation
Author
Journal/Citation
Institution
PubMed
PubChem BioAssay
US Patent
Special Data Sets
D3R
Host Guest Systems
Prot-Lig Validation Sets
Other Databases
PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
PubMed
Download
All Compounds & Data
Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
Enter Data
Deposition
Contribute data
Sent Comments
Compile Data Set for Download or QSAR
Found
45
hits Enz. Inhib. hit(s) with all data for entry = 50012935
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Mus musculus)
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.200
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of mouse UGT8 assessed as redcution in GalCer accumulation
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.200
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.200
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Mus musculus)
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.300
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of mouse UGT8 assessed as redcution in SFT accumulation
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561671
(CHEMBL4796521)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NCCOC(F)(F)F)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.400
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561669
(CHEMBL4787939)
Show SMILES
CC[C@H](C)NC(=O)OC1CCN(CC1)c1cc(c2scc(C(=O)NC)c2n1)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.400
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561671
(CHEMBL4796521)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NCCOC(F)(F)F)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.600
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561670
(CHEMBL4750073)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)C1CC1)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.900
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561669
(CHEMBL4787939)
Show SMILES
CC[C@H](C)NC(=O)OC1CCN(CC1)c1cc(c2scc(C(=O)NC)c2n1)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
0.900
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561664
(CHEMBL4776963)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561670
(CHEMBL4750073)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)C1CC1)C(F)(F)F |r|
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.10
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561672
(CHEMBL4750432)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N1CC(C1)OC(F)(F)F)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.70
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561663
(CHEMBL4765010)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NC(C)C)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
2
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561663
(CHEMBL4765010)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NC(C)C)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
2
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561672
(CHEMBL4750432)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N1CC(C1)OC(F)(F)F)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
2.90
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561664
(CHEMBL4776963)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561665
(CHEMBL4755797)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)NC(=O)OCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
18
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561665
(CHEMBL4755797)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)NC(=O)OCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
37
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561667
(CHEMBL4757982)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CC(C1)NC(=O)OCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
43
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561667
(CHEMBL4757982)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CC(C1)NC(=O)OCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
48
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561655
(CHEMBL4760937)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)NC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
67
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561655
(CHEMBL4760937)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)NC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
90
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561657
(CHEMBL4795937)
Show SMILES
CCC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)NC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
97
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561657
(CHEMBL4795937)
Show SMILES
CCC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)NC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
120
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561658
(CHEMBL4799472)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC1)C(C)C(=O)NC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
170
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561662
(CHEMBL4797076)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(O)COC(C)(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
190
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561661
(CHEMBL4751927)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CCOC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
200
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561668
(CHEMBL4764180)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CC(C1)OC(=O)NCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
200
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561656
(CHEMBL4747085)
Show SMILES
CC(C)NC(=O)CN1CCN(CC1)c1cc(c2scc(C(=O)N3CCC3)c2n1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
320
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561661
(CHEMBL4751927)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CCOC(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
330
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561662
(CHEMBL4797076)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(O)COC(C)(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
350
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561658
(CHEMBL4799472)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC1)C(C)C(=O)NC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
360
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561659
(CHEMBL4745037)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC1)C(=O)COC(C)C)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
450
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561673
(CHEMBL4799203)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)NCCN1CCCC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
510
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561660
(CHEMBL4791074)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)C(C)(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
610
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561666
(CHEMBL4762406)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(C1)OC(=O)NCC1CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
610
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561656
(CHEMBL4747085)
Show SMILES
CC(C)NC(=O)CN1CCN(CC1)c1cc(c2scc(C(=O)N3CCC3)c2n1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
640
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561659
(CHEMBL4745037)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC1)C(=O)COC(C)C)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
660
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561674
(CHEMBL4752928)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N1CC(CN(C)C)C1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
980
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in SFT accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
2-hydroxyacylsphingosine 1-beta-galactosyltransferase
(Homo sapiens)
BDBM50561660
(CHEMBL4791074)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCN(CC(=O)C(C)(C)C)CC1)C(F)(F)F
Show InChI
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.40E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT8 in human OE19 cells assessed as redcution in GalCer accumulation measured after 72 hrs by LC-MS/MS analysis
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
UDP-glucuronosyltransferase 1-6
(Homo sapiens (Human))
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT1A6 (unknown origin)
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
UDP-glucuronosyltransferase 2B7
(Homo sapiens (Human))
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT2B7 (unknown origin)
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
UDP-glucuronosyltransferase 2B15
(Homo sapiens)
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT2B15 (unknown origin)
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
UDP-glucuronosyltransferase 2B17
(Homo sapiens (Human))
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT2B17 (unknown origin)
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
UDP-glucuronosyltransferase 1A1
(Homo sapiens (Human))
BDBM50561654
(CHEMBL4785914)
Show SMILES
CNC(=O)c1csc2c(cc(nc12)N1CCC(CC1)OC(=O)N[C@@H](C)COC(F)(F)F)C(F)(F)F |r|
Show InChI
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of UGT1A1 (unknown origin)
Citation and Details
Article DOI:
10.1021/acsmedchemlett.0c00120
BindingDB Entry DOI:
10.7270/Q2ZG6WX8
More data for this
Ligand-Target Pair
Search and Browse
Download
Enter Data
