Reaction Details Report a problem with these data
Target
Transthyretin
Ligand
BDBM576403
Substrate
n/a
Meas. Tech.
KD Determination by SPR
Kd
27±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:
BDBM576403
Synonyms:
5-methyl-4-(7-methyl-1,3-benzothiazol-4-yl)-1H-pyrazole-3-carbonitrile | WO2022112919, Example 8
Type:
Small organic molecule
Emp. Form.:
C13H10N4S
Mol. Mass.:
254.31
SMILES:
Cc1[nH]nc(C#N)c1-c1ccc(C)c2scnc12 |(.45,-3.14,;1.36,-1.89,;2.9,-1.89,;3.37,-.43,;2.13,.48,;2.13,2.02,;2.13,3.56,;.88,-.43,;-.59,.05,;-.91,1.55,;-2.37,2.03,;-3.51,1,;-4.98,1.48,;-3.19,-.51,;-4.1,-1.75,;-3.19,-3,;-1.73,-2.52,;-1.73,-.98,)|
Structure:
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