Reaction Details Report a problem with these data
Target
Albumin
Ligand
BDBM96356
Substrate
n/a
IC50
>94047±n/a nM
Citation
 PubChem, PC Counterscreen for inhibitors of T-cell receptor (TCR)-CD3 interaction: Fluorescence-based biochemical high throughput dose response assay to identify inhibitors of T-cell receptor (TCR)-CD3 interaction using a TAMRA-labeled BSA probe PubChem Bioassay (2013)[AID] 
Target
Name:
Albumin
Synonyms:
ALB | ALBU_BOVIN | Serum albumin | serum albumin precursor
Type:
PROTEIN
Mol. Mass.:
69288.15
Organism:
Bos taurus
Description:
ChEMBL_1502598
Residue:
607
Sequence:
MKWVTFISLLLLFSSAYSRGVFRRDTHKSEIAHRFKDLGEEHFKGLVLIAFSQYLQQCPFDEHVKLVNELTEFAKTCVADESHAGCEKSLHTLFGDELCKVASLRETYGDMADCCEKQEPERNECFLSHKDDSPDLPKLKPDPNTLCDEFKADEKKFWGKYLYEIARRHPYFYAPELLYYANKYNGVFQECCQAEDKGACLLPKIETMREKVLASSARQRLRCASIQKFGERALKAWSVARLSQKFPKAEFVEVTKLVTDLTKVHKECCHGDLLECADDRADLAKYICDNQDTISSKLKECCDKPLLEKSHCIAEVEKDAIPENLPPLTADFAEDKDVCKNYQEAKDAFLGSFLYEYSRRHPEYAVSVLLRLAKEYEATLEECCAKDDPHACYSTVFDKLKHLVDEPQNLIKQNCDQFEKLGEYGFQNALIVRYTRKVPQVSTPTLVEVSRSLGKVGTRCCTKPESERMPCTEDYLSLILNRLCVLHEKTPVSEKVTKCCTESLVNRRPCFSALTPDETYVPKAFDEKLFTFHADICTLPDTEKQIKKQTALVELLKHKPKATEEQLKTVMENFVAFVDKCCAADDKEACFAVEGPKLVVSTQTALA
  
Inhibitor
Name:
BDBM96356
Synonyms:
4-Hydroxy-2-oxo-1,2-dihydro-quinoline-3-carboxylic acid N'-(2-chloro-acetyl)-hydrazide | MLS000777624 | N'-(2-chloranylethanoyl)-4-oxidanyl-2-oxidanylidene-1H-quinoline-3-carbohydrazide | N'-(2-chloro-1-oxoethyl)-4-hydroxy-2-oxo-1H-quinoline-3-carbohydrazide | N'-(2-chloroacetyl)-4-hydroxy-2-keto-1H-quinoline-3-carbohydrazide | N'-(2-chloroacetyl)-4-hydroxy-2-oxo-1H-quinoline-3-carbohydrazide | SMR000414018 | cid_54679578
Type:
Small organic molecule
Emp. Form.:
C12H10ClN3O4
Mol. Mass.:
295.679
SMILES:
Oc1c(C(=O)NNC(=O)CCl)c(=O)[nH]c2ccccc12
Structure:
Search PDB for entries with ligand similarity: