Reaction Details Report a problem with these data
Target
Stearoyl-CoA desaturase
Ligand
BDBM50448659
Substrate
n/a
Meas. Tech.
ChEMBL_1296562 (CHEMBL3130897)
IC50
2.0±n/a nM
Citation
 Yang, SM; Tang, Y; Rano, T; Lu, H; Kuo, GH; Gaul, MD; Li, Y; Ho, G; Lang, W; Conway, JG; Liang, Y; Lenhard, JM; Demarest, KT; Murray, WV 4-Bicyclic heteroaryl-piperidine derivatives as potent, orally bioavailable stearoyl-CoA desaturase-1 (SCD1) inhibitors: part 2. Pyridazine-based analogs. Bioorg Med Chem Lett 24:1437-41 (2014) [PubMed]  Article 
Target
Name:
Stearoyl-CoA desaturase
Synonyms:
Acyl-CoA desaturase | FADS5 | SCD | SCD1 | SCDOS | SCD_HUMAN | Stearoyl-CoA (SCD1) | Stearoyl-CoA desaturase 1
Type:
Enzyme
Mol. Mass.:
41537.27
Organism:
Homo sapiens (Human)
Description:
O00767
Residue:
359
Sequence:
MPAHLLQDDISSSYTTTTTITAPPSRVLQNGGDKLETMPLYLEDDIRPDIKDDIYDPTYKDKEGPSPKVEYVWRNIILMSLLHLGALYGITLIPTCKFYTWLWGVFYYFVSALGITAGAHRLWSHRSYKARLPLRLFLIIANTMAFQNDVYEWARDHRAHHKFSETHADPHNSRRGFFFSHVGWLLVRKHPAVKEKGSTLDLSDLEAEKLVMFQRRYYKPGLLMMCFILPTLVPWYFWGETFQNSVFVATFLRYAVVLNATWLVNSAAHLFGYRPYDKNISPRENILVSLGAVGEGFHNYHHSFPYDYSASEYRWHINFTTFFIDCMAALGLAYDRKKVSKAAILARIKRTGDGNYKSG
  
Inhibitor
Name:
BDBM50448659
Synonyms:
CHEMBL3127654
Type:
Small organic molecule
Emp. Form.:
C21H22FN5S
Mol. Mass.:
395.496
SMILES:
Cc1csc(n1)-c1ccc(nn1)N1CCC(CC1)N1CCc2ccc(F)cc12
Structure:
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