Reaction Details Report a problem with these data
Target
Programmed cell death 1 ligand 1
Ligand
BDBM50605272
Substrate
n/a
Meas. Tech.
ChEMBL_2250880 (CHEMBL5165090)
Kd
584±n/a nM
Citation
 Le Biannic, R; Magnez, R; Klupsch, F; Leleu-Chavain, N; Thiroux, B; Tardy, M; El Bouazzati, H; Dezitter, X; Renault, N; Vergoten, G; Bailly, C; Quesnel, B; Thuru, X; Millet, R Pyrazolones as inhibitors of immune checkpoint blocking the PD-1/PD-L1 interaction. Eur J Med Chem 236:0 (2022) [PubMed] 
Target
Name:
Programmed cell death 1 ligand 1
Synonyms:
B7 homolog 1 | B7-H1 | B7H1 | B7H1 | CD274 | CD_antigen=CD274 | PD-L1 | PD1L1_HUMAN | PDCD1 ligand 1 | PDCD1L1 | PDCD1LG1 | PDL1 | Programmed cell death 1 ligand 1 | Programmed death ligand 1
Type:
PROTEIN
Mol. Mass.:
33278.49
Organism:
Homo sapiens (Human)
Description:
ChEMBL_109807
Residue:
290
Sequence:
MRIFAVFIFMTYWHLLNAFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQFVHGEEDLKVQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMISYGGADYKRITVKVNAPYNKINQRILVVDPVTSEHELTCQAEGYPKAEVIWTSSDHQVLSGKTTTTNSKREEKLFNVTSTLRINTTTNEIFYCTFRRLDPEENHTAELVIPELPLAHPPNERTHLVILGAILLCLGVALTFIFRLRKGRMMDVKKCGIQDTNSKKQSDTHLEET
  
Inhibitor
Name:
BDBM50605272
Synonyms:
CHEMBL5194707
Type:
Small organic molecule
Emp. Form.:
C14H9Cl2N3O
Mol. Mass.:
306.147
SMILES:
Clc1ccc(cc1Cl)C1=NN(C(=O)C1)c1ccccn1 |t:9|
Structure:
Search PDB for entries with ligand similarity: