Ki Summary

Reaction Details

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Target

Peroxisome proliferator-activated receptor alpha

Ligand

BDBM50362974

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_801274 (CHEMBL1947823)

IC50

>50000±n/a nM

Citation

Liu, W; Lau, F; Liu, K; Wood, HB; Zhou, G; Chen, Y; Li, Y; Akiyama, TE; Castriota, G; Einstein, M; Wang, C; McCann, ME; Doebber, TW; Wu, M; Chang, CH; McNamara, L; McKeever, B; Mosley, RT; Berger, JP; Meinke, PT Benzimidazolones: a new class of selective peroxisome proliferator-activated receptor¿ (PPAR¿) modulators. J Med Chem54:8541-54 (2011) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Peroxisome proliferator-activated receptor alpha

Name:

Peroxisome proliferator-activated receptor alpha

Synonyms:

Type:

Enzyme

Mol. Mass.:

52222.08

Organism:

Homo sapiens (Human)

Description:

Q07869

Residue:

468

Sequence:

MVDTESPLCPLSPLEAGDLESPLSEEFLQEMGNIQEISQSIGEDSSGSFGFTEYQYLGSC
PGSDGSVITDTLSPASSPSSVTYPVVPGSVDESPSGALNIECRICGDKASGYHYGVHACE
GCKGFFRRTIRLKLVYDKCDRSCKIQKKNRNKCQYCRFHKCLSVGMSHNAIRFGRMPRSE
KAKLKAEILTCEHDIEDSETADLKSLAKRIYEAYLKNFNMNKVKARVILSGKASNNPPFV
IHDMETLCMAEKTLVAKLVANGIQNKEAEVRIFHCCQCTSVETVTELTEFAKAIPGFANL
DLNDQVTLLKYGVYEAIFAMLSSVMNKDGMLVAYGNGFITREFLKSLRKPFCDIMEPKFD
FAMKFNALELDDSDISLFVAAIICCGDRPGLLNVGHIEKMQEGIVHVLRLHLQSNHPDDI
FLFPKLLQKMADLRQLVTEHAQLVQIIKKTESDAALHPLLQEIYRDMY

BDBM50362974

n/a

Name

BDBM50362974

Synonyms:

CHEMBL1946753

Type

Small organic molecule

Emp. Form.

C26H19ClF3N3O5

Mol. Mass.

545.894

SMILES

C[C@@H](Oc1cc(Cn2c3cc(ccc3n(-c3noc4cc(C)ccc34)c2=O)C(F)(F)F)ccc1Cl)C(O)=O |r,wU:1.0,(3.59,-34.44,;3.56,-32.9,;2.21,-32.16,;.89,-32.95,;-.45,-32.21,;-1.76,-33.01,;-3.11,-32.26,;-3.13,-30.72,;-4.6,-30.25,;-5.94,-31.03,;-7.28,-30.26,;-7.27,-28.72,;-5.95,-27.94,;-4.61,-28.71,;-3.15,-28.22,;-2.38,-26.89,;-3.28,-25.64,;-2.37,-24.4,;-.91,-24.89,;.42,-24.13,;1.76,-24.9,;3.09,-24.13,;1.75,-26.45,;.41,-27.21,;-.92,-26.43,;-2.23,-29.47,;-.69,-29.46,;-8.61,-31.03,;-9.94,-30.26,;-8.61,-32.57,;-9.96,-31.79,;-1.74,-34.54,;-.4,-35.29,;.92,-34.5,;2.27,-35.25,;4.88,-32.1,;6.23,-32.84,;4.84,-30.56,)|

Structure