Reaction Details Report a problem with these data
Target
Oxysterol-binding protein 2
Ligand
BDBM50617152
Substrate
n/a
Meas. Tech.
ChEMBL_2311003
Ki
78±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 2
Synonyms:
OSBP2_HUMAN | OSBP2 | KIAA1664 | ORP4 | OSBPL4 | OSBP-related protein 4 (ORP4L)
Type:
Protein
Mol. Mass.:
101264.66
Organism:
Human
Description:
Q969R2
Residue:
916
Sequence:
MGKAAAPSRGGGCGGRSRGLSSLFTVVPCLSCHTAAPGMSASTSGSGPEPKPQPQPVPEPERGPLSEQVSEAVSEAVPRSEPVSETTSEPEPGAGQPSELLQGSRPGSESSSGVGAGPFTKAASEPLSRAVGSATFLRPESGSLPALKPLPLLRPGQAKTPLGVPMSGTGTTSSAPLALLPLDSFEGWLLKWTNYLKGYQRRWFVLGNGLLSYYRNQGEMAHTCRGTINLSTAHIDTEDSCGILLTSGARSYHLKASSEVDRQQWITALELAKAKAVRVMNTHSDDSGDDDEATTPADKSELHHTLKNLSLKLDDLSTCNDLIAKHGAALQRSLTELDGLKIPSESGEKLKVVNERATLFRITSNAMINACRDFLELAEIHSRKWQRALQYEQEQRVHLEETIEQLAKQHNSLERAFHSAPGRPANPSKSFIEGSLLTPKGEDSEEDEDTEYFDAMEDSTSFITVITEAKEDSRKAEGSTGTSSVDWSSADNVLDGASLVPKGSSKVKRRVRIPNKPNYSLNLWSIMKNCIGRELSRIPMPVNFNEPLSMLQRLTEDLEYHHLLDKAVHCTSSVEQMCLVAAFSVSSYSTTVHRIAKPFNPMLGETFELDRLDDMGLRSLCEQVSHHPPSAAHYVFSKHGWSLWQEITISSKFRGKYISIMPLGAIHLEFQASGNHYVWRKSTSTVHNIIVGKLWIDQSGDIEIVNHKTNDRCQLKFLPYSYFSKEAARKVTGVVSDSQGKAHYVLSGSWDEQMECSKVMHSSPSSPSSDGKQKTVYQTLSAKLLWKKYPLPENAENMYYFSELALTLNEHEEGVAPTDSRLRPDQRLMEKGRWDEANTEKQRLEEKQRLSRRRRLEACGPGSSCSSEEEKEADAYTPLWFEKRLDPLTGEMACVYKGGYWEAKEKQDWHMCPNIF
  
Inhibitor
Name:
BDBM50617152
Synonyms:
CEPHALOSTATIN 1 | CHEBI:69376 | Cephalostatin 1
Type:
Small organic molecule
Emp. Form.:
C54H74N2O10
Mol. Mass.:
911.19
SMILES:
[H][C@]12CC=C3[C@]4([H])CC[C@@]5([H])Cc6nc7C[C@@]8(C)[C@@]([H])(CC[C@@]9([H])C%10=C[C@]%11([H])O[C@]%12(O[C@](C)(CO)C[C@H]%12O)[C@@H](C)[C@]%11(O)[C@@]%10(C)[C@H](O)C[C@]89[H])Cc7nc6C[C@]5(C)[C@@]4([H])CC(=O)[C@]13CO[C@@]1(OC(C)(C)C[C@H]1O)[C@H]2C |r,t:3,24|
Structure:
Search PDB for entries with ligand similarity: