Reaction Details Report a problem with these data
Target
Transthyretin
Ligand
BDBM576409
Substrate
n/a
Meas. Tech.
KD Determination by SPR
Kd
31±n/a nM
Citation
 Shawn, C; Paul, CD; Lee, DR; Andrew, F; Magdalena, K; Yvette, LS; Timothy, LA; Vincent, M; Walter, PD; Andre, S; Mike, TM; Tao, W; Maria, WH (AZA)BENZOTHIAZOLYL SUBSTITUTED PYRAZOLE COMPOUNDS WIPO 0:0 (2022) [PubMed] 
Target
Name:
Transthyretin
Synonyms:
ATTR | PALB | Prealbumin | TBPA | TTHY_HUMAN | TTR | Transthyretin (TTR)
Type:
Enzyme
Mol. Mass.:
15884.31
Organism:
Homo sapiens (Human)
Description:
P02766
Residue:
147
Sequence:
MASHRLLLLCLAGLVFVSEAGPTGTGESKCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTTAVVTNPKE
  
Inhibitor
Name:
BDBM576409
Synonyms:
4-(3,5-dimethyl-1H-pyrazol-4-yl)-6-methoxy-1,3-benzothiazole | WO2022112919, Example 14
Type:
Small organic molecule
Emp. Form.:
C13H13N3OS
Mol. Mass.:
259.327
SMILES:
COc1cc(-c2c(C)n[nH]c2C)c2ncsc2c1 |(-4.16,4.01,;-2.69,3.54,;-2.37,2.03,;-.91,1.55,;-.59,.05,;.88,-.43,;2.13,.48,;2.13,2.02,;3.37,-.43,;2.9,-1.89,;1.36,-1.89,;.45,-3.14,;-1.73,-.98,;-1.73,-2.52,;-3.19,-3,;-4.1,-1.75,;-3.19,-.51,;-3.51,1,)|
Structure:
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