Reaction Details Report a problem with these data
Target
Leukotriene C4 synthase
Ligand
BDBM223256
Substrate
LTC4
Meas. Tech.
In Vitro hLTC4 Synthase Enzyme Assay (Test A)
pH
7.8±n/a
IC50
331±n/a nM
Comments
extracted
Citation
 Ronn, R; Lindh, CJ; Ringberg, E; Andersson, HB; Nilsson, P; Schaal, WR; Rosenschold, MM; Nikitidis, A; Nikitidis, G; Johannesson, P; Tyrcha, C Compounds and uses  US Patent  US20160326143 Publication Date 11/10/2016 
Target
Name:
Leukotriene C4 synthase
Synonyms:
LTC4 synthase | LTC4S | LTC4S_HUMAN | Leukotriene-C(4) synthase
Type:
PROTEIN
Mol. Mass.:
16575.59
Organism:
Homo sapiens (Human)
Description:
ChEMBL_961179
Residue:
150
Sequence:
MKDEVALLAAVTLLGVLLQAYFSLQVISARRAFRVSPPLTTGPPEFERVYRAQVNCSEYFPLFLATLWVAGIFFHEGAAALCGLVYLFARLRYFQGYARSAQLRLAPLYASARALWLLVALAALGLLAHFLPAALRAALLGRLRTLLPWA
  
Inhibitor
Name:
BDBM223256
Synonyms:
2-(5-((Cyclopropylmethyl)(2-fluoro-3-(trifluoromethyl)benzyl)amino)-3-methoxypicolinoyl)cyclopropanecarboxylic acid | US20160326143, 31 | US9657001, 31
Type:
Small Organic Molecule
Emp. Form.:
C23H22F4N2O4
Mol. Mass.:
466.4254
SMILES:
COc1cc(cnc1C(=O)C1CC1C(O)=O)N(CC1CC1)Cc1cccc(c1F)C(F)(F)F
Structure:
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Substrate
Name:
BDBM81801
Synonyms:
CAS_5283121 | LTC4 | NSC_5283121
Type:
Small organic molecule
Emp. Form.:
C30H47N3O9S
Mol. Mass.:
625.774
SMILES:
CCCCCC=CCC=CC=CC=CC(SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O)C(O)CCCC(O)=O |w:5.4,8.7,10.9,12.11|
Structure:
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