Reaction Details Report a problem with these data
Target
Fatty acid-binding protein, adipocyte
Ligand
BDBM234703
Substrate
n/a
Meas. Tech.
Time Resolved-Fluorescence Energy Transfer (TR-FRET) Assay
pH
7.5±n/a
IC50
27±n/a nM
Comments
extracted
Citation
 Buettelmann, B; Ceccarelli, SM; Kuehne, H; Kuhn, B; Neidhart, W; Obst Sander, U; Richter, H Non-annulated thiophenylamides US Patent  US9353102 Publication Date 5/31/2016 
Target
Name:
Fatty acid-binding protein, adipocyte
Synonyms:
A-FABP | AFABP | ALBP | Adipocyte lipid-binding protein | FABP4 | FABP4_HUMAN | Fatty acid binding protein adipocyte | Fatty acid-binding protein 4 | Fatty acid-binding protein 4 (FABP4)
Type:
Enzyme
Mol. Mass.:
14719.23
Organism:
Homo sapiens (Human)
Description:
P15090
Residue:
132
Sequence:
MCDAFVGTWKLVSSENFDDYMKEVGVGFATRKVAGMAKPNMIISVNGDVITIKSESTFKNTEISFILGQEFDEVTADDRKVKSTITLDGGVLVHVQKWDGKSTTIKRKREDDKLVVECVMKGVTSTRVYERA
  
Inhibitor
Name:
BDBM234703
Synonyms:
US9353102, 4.9
Type:
Small organic molecule
Emp. Form.:
C21H23N3O3S2
Mol. Mass.:
429.556
SMILES:
Cc1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(c1C)-c1nc(ns1)C1CC1 |t:7,TLB:5:7:10.11:13.14,THB:15:8:10.11:13.14,(-5.26,-2.39,;-3.93,-1.62,;-2.47,-2.1,;-1.56,-.85,;-.02,-.85,;.75,-2.18,;-.02,-3.52,;2.29,-2.18,;3.38,-3.27,;4.87,-2.87,;5.26,-1.39,;4.18,-.3,;2.69,-.7,;3.46,-2.03,;4.87,-1.33,;2.98,-4.76,;1.49,-5.16,;4.07,-5.85,;-2.47,.4,;-3.93,-.08,;-5.26,.69,;-1.7,1.73,;-.23,2.21,;-.23,3.75,;-1.7,4.22,;-2.6,2.98,;1.1,4.52,;2.64,4.52,;1.87,5.85,)|
Structure:
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