Ki Summary

Reaction Details

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Target

Squalene synthase

Ligand

BDBM50270323

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_520603 (CHEMBL959525)

IC50

>1000±n/a nM

Citation

Cammerer, SB; Jimenez, C; Jones, S; Gros, L; Lorente, SO; Rodrigues, C; Rodrigues, JC; Caldera, A; Ruiz Perez, LM; da Souza, W; Kaiser, M; Brun, R; Urbina, JA; Gonzalez Pacanowska, D; Gilbert, IH Quinuclidine derivatives as potential antiparasitics. Antimicrob Agents Chemother51:4049-61 (2007) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Squalene synthase

Name:

Squalene synthase

Synonyms:

Farnesyltransferase, putative

Type:

PROTEIN

Mol. Mass.:

47117.40

Organism:

Leishmania major

Description:

ChEMBL_520603

Residue:

414

Sequence:

MGFFSDSVAMMRVKWQMRSVKIQVPPEETDLRFCYDIMNDVSRSFAVVVAQLADQQLRDA
ICIFYLVLRALDTLEDDMSVPVDVKLKELPKFHTHTSDMSWCMSGVGEGRERELLAKYPC
VSREFKKLKKEYQDVIANICERMANGMCEFLKRPVVTKDDYNQYCHYVAGLVGHGLTQLF
ARCGFEDPSLDDDLTSSNHMGLFLQKTNIIRDYYEDIREEPPRMFWPKEIWGTYVTELKE
LKSESNNAAAVQCLNAMVADALVHVPYIVDYLSALRDPSVFRFCAIPQVMAIATLKEVYN
NPDTFQVKVKVSRPESCRIMLKATTLYSSLSMFRDYCVELQEKLDMQDASSVSIANSLAA
AIERIDLQLKKCQDVSYTRSLLARYPGLGGQFLLTVMDTVAGFFGGRKEIAGHA

BDBM50270323

n/a

Name

BDBM50270323

Synonyms:

3-(3'-Quinolyl)-quinuclidine-2-ene | CHEMBL478340

Type

Small organic molecule

Emp. Form.

C16H16N2

Mol. Mass.

236.3116

SMILES

C1CN2CCC1C(=C2)c1cnc2ccccc2c1 |c:7,(20.51,-11.4,;20.51,-12.95,;21.84,-13.72,;22.59,-12.38,;21.11,-11.98,;21.84,-10.63,;23.18,-11.4,;23.18,-12.95,;24.51,-10.64,;25.84,-11.41,;27.17,-10.64,;27.17,-9.1,;28.5,-8.33,;28.5,-6.79,;27.15,-6.02,;25.83,-6.8,;25.83,-8.33,;24.51,-9.1,)|

Structure