Reaction Details Report a problem with these data
Target
Oxysterol-binding protein 1
Ligand
BDBM50617161
Substrate
n/a
Meas. Tech.
ChEMBL_2311006
Ki
>50000±n/a nM
Citation
 Severance, ZC; Nuñez, JI; Le-McClain, AT; Malinky, CA; Bensen, RC; Fogle, RS; Manginelli, GW; Sakers, SH; Falcon, EC; Bui, RH; Snead, KJ; Bourne, CR; Burgett, AWG Structure-Activity Relationships of Ligand Binding to Oxysterol-Binding Protein (OSBP) and OSBP-Related Protein 4. J Med Chem 66:3866-3875 (2023) [PubMed] 
Target
Name:
Oxysterol-binding protein 1
Synonyms:
OSBP | OSBP1 | Oxysterol-binding protein 1
Type:
PROTEIN
Mol. Mass.:
89428.62
Organism:
Homo sapiens
Description:
ChEMBL_118953
Residue:
807
Sequence:
MAATELRGVVGPGPAAIAALGGGGAGPPVVGGGGGRGDAGPGSGAASGTVVAAAAGGPGPGAGGVAAAGPAPAPPTGGSGGSGAGGSGSAREGWLFKWTNYIKGYQRRWFVLSNGLLSYYRSKAEMRHTCRGTINLATANITVEDSCNFIISNGGAQTYHLKASSEVERQRWVTALELAKAKAVKMLAESDESGDEESVSQTDKTELQNTLRTLSSKVEDLSTCNDLIAKHGTALQRSLSELESLKLPAESNEKIKQVNERATLFRITSNAMINACRDFLMLAQTHSKKWQKSLQYERDQRIRLEETLEQLAKQHNHLERAFRGATVLPANTPGNVGSGKDQCCSGKGDMSDEDDENEFFDAPEIITMPENLGHKRTGSNISGASSDISLDEQYKHQLEETKKEKRTRIPYKPNYSLNLWSIMKNCIGKELSKIPMPVNFNEPLSMLQRLTEDLEYHELLDRAAKCENSLEQLCYVAAFTVSSYSTTVFRTSKPFNPLLGETFELDRLEENGYRSLCEQVSHHPPAAAHHAESKNGWTLRQEIKITSKFRGKYLSIMPLGTIHCIFHATGHHYTWKKVTTTVHNIIVGKLWIDQSGEIDIVNHKTGDKCNLKFVPYSYFSRDVARKVTGEVTDPSGKVHFALLGTWDEKMECFKVQPVIGENGGDARQRGHEAEESRVMLWKRNPLPKNAENMYYFSELALTLNAWESGTAPTDSRLRPDQRLMENGRWDEANAEKQRLEEKQRLSRKKREAEAMKATEDGTPYDPYKALWFERKKDPVTKELTHIYRGEYWECKEKQDWSSCPDIF
  
Inhibitor
Name:
BDBM50617161
Synonyms:
CHEMBL5406469
Type:
Small organic molecule
Emp. Form.:
C21H32O3
Mol. Mass.:
332.48
SMILES:
[H][C@@]12CC=C([C@H](O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |r,t:3,20|
Structure:
Search PDB for entries with ligand similarity: