Reaction Details Report a problem with these data
Target
Squalene synthase
Ligand
BDBM50031837
Substrate
n/a
Meas. Tech.
ChEMBL_202094 (CHEMBL813351)
IC50
13.1±n/a nM
Citation
Magnin, DR; Biller, SA; Dickson, JK; Logan, JV; Lawrence, RM; Chen, Y; Sulsky, RB; Ciosek, CP; Harrity, TW; Jolibois, KG 1,1-Bisphosphonate squalene synthase inhibitors: interplay between the isoprenoid subunit and the diphosphate surrogate. J Med Chem 38:2596-605 (1995) [PubMed] Article
More Info.:
Target
Name:
Squalene synthase
Synonyms:
FDFT_RAT | FPP:FPP farnesyltransferase | Farnesyl-diphosphate farnesyltransferase | Fdft1 | SQS | SS | Squalene synthetase
Type:
PROTEIN
Mol. Mass.:
48109.41
Organism:
Rattus norvegicus
Description:
ChEMBL_1336736
Residue:
416
Sequence:
MEFVKCLGHPEEFYNLLRFRMGGRRNFIPKMDRNSLSNSLKTCYKYLDQTSRSFAAVIQALDGDIRHAVCVFYLILRAMDTVEDDMAISVEKKIPLLRNFHTFLYEPEWRFTESKEKHRVVLEDFPTISLEFRNLAEKYQTVIADICHRMGCGMAEFLNKDVTSKQDWDKYCHYVAGLVGIGLSRLFSASEFEDPIVGEDTECANSMGLFLQKTNIIRDYLEDQQEGRQFWPQEVWGKYVKKLEDFVKPENVDVAVKCLNELITNALQHIPDVITYLSRLRNQSVFNFCAIPQVMAIATLAACYNNHQVFKGVVKIRKGQAVTLMMDATNMPAVKAIIYQYIEEIYHRVPNSDPSASKAKQLISNIRTQSLPNCQLISRSHYSPIYLSFIMLLAALSWQYLSTLSQVTEDYVQREH
Inhibitor
Name:
BDBM50031837
Synonyms:
CHEMBL87489 | [(E)-1-(Hydroxy-methoxymethyl-phosphinoyl)-6,10-dimethyl-undeca-5,9-dienyl]-phosphonic acid
Type:
Small organic molecule
Emp. Form.:
C15H30O6P2
Mol. Mass.:
368.3426
SMILES:
[#6]-[#8]-[#6]P([#8])(=O)[#6](-[#6]-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])P([#8])([#8])=O