Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCeramide glucosyltransferase
LigandBDBM367661
Substrate/Competitorn/a
Meas. Tech.GCS Enzymatic Assay
IC50 5.5±n/a nM
Citation Wang, B Glucosylceramide synthase inhibitors for the treatment of diseases US Patent US10227312 Publication Date 3/12/2019
More Info.:Get all data from this article,  Assay Method
 
Ceramide glucosyltransferase
Name:Ceramide glucosyltransferase
Synonyms:CEGT_HUMAN | GCS | GLCT-1 | Glucosylceramide synthase | UDP-glucose ceramide glucosyltransferase | UDP-glucose:N-acylsphingosine D-glucosyltransferase | UGCG
Type:PROTEIN
Mol. Mass.:44859.25
Organism:Homo sapiens (Human)
Description:ChEMBL_1435474
Residue:394
Sequence:
MALLDLALEGMAVFGFVLFLVLWLMHFMAIIYTRLHLNKKATDKQPYSKLPGVSLLKPLK
GVDPNLINNLETFFELDYPKYEVLLCVQDHDDPAIDVCKKLLGKYPNVDARLFIGGKKVG
INPKINNLMPGYEVAKYDLIWICDSGIRVIPDTLTDMVNQMTEKVGLVHGLPYVADRQGF
AATLEQVYFGTSHPRYYISANVTGFKCVTGMSCLMRKDVLDQAGGLIAFAQYIAEDYFMA
KAIADRGWRFAMSTQVAMQNSGSYSISQFQSRMIRWTKLRINMLPATIICEPISECFVAS
LIIGWAAHHVFRWDIMVFFMCHCLAWFIFDYIQLRGVQGGTLCFSKLDYAVAWFIRESMT
IYIFLSALWDPTISWRTGRYRLRCGGTAEEILDV
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM367661
n/a
NameBDBM367661
Synonyms:2-chloro-N-((1R,2R)-1-(4- cyclopropoxy-3-fluorophenyl)-1- hydroxy-3-(pyrrolidin-1-yl)propan-2- yl)-9H-thieno[2',3':3,4]benzo[1,2- d][1,2]oxazine-6-carboxamide | US10227312, Example 47 | US10759769, Example 47
TypeSmall organic molecule
Emp. Form.C27H27ClFN3O4S
Mol. Mass.544.037
SMILESO[C@@H]([C@@H](CN1CCCC1)NC(=O)C1=NOCc2c1ccc1cc(Cl)sc21)c1ccc(OC2CC2)c(F)c1 |r,t:13|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: