Reaction Details Report a problem with these data
Target
P2Y purinoceptor 12
Ligand
BDBM50397190
Substrate
n/a
Meas. Tech.
ChEMBL_864185 (CHEMBL2175134)
Ki
66±n/a nM
Citation
 Zech, G; Hessler, G; Evers, A; Weiss, T; Florian, P; Just, M; Czech, J; Czechtizky, W; Görlitzer, J; Ruf, S; Kohlmann, M; Nazaré, M Identification of high-affinity P2Y12 antagonists based on a phenylpyrazole glutamic acid piperazine backbone. J Med Chem 55:8615-29 (2012) [PubMed]  Article 
Target
Name:
P2Y purinoceptor 12
Synonyms:
ADP-glucose receptor | ADPG-R | HORK3 | P2RY12 | P2T(AC) | P2Y purinoceptor 12 | P2Y(AC) | P2Y(ADP) | P2Y(cyc) | P2Y12 | P2Y12 platelet ADP receptor | P2Y12_HUMAN | Purinergic receptor P2Y12 | SP1999
Type:
Enzyme
Mol. Mass.:
39458.48
Organism:
Homo sapiens (Human)
Description:
Q9H244
Residue:
342
Sequence:
MQAVDNLTSAPGNTSLCTRDYKITQVLFPLLYTVLFFVGLITNGLAMRIFFQIRSKSNFIIFLKNTVISDLLMILTFPFKILSDAKLGTGPLRTFVCQVTSVIFYFTMYISISFLGLITIDRYQKTTRPFKTSNPKNLLGAKILSVVIWAFMFLLSLPNMILTNRQPRDKNVKKCSFLKSEFGLVWHEIVNYICQVIFWINFLIVIVCYTLITKELYRSYVRTRGVGKVPRKKVNVKVFIIIAVFFICFVPFHFARIPYTLSQTRDVFDCTAENTLFYVKESTLWLTSLNACLDPFIYFFLCKSFRNSLISMLKCPNSATSLSQDNRKKEQDGGDPNEETPM
  
Inhibitor
Name:
BDBM50397190
Synonyms:
CHEMBL2172267
Type:
Small organic molecule
Emp. Form.:
C32H43N7O9
Mol. Mass.:
669.7253
SMILES:
CCCNC(=O)[C@@H]1CCCN1C(=O)COc1cc(nn1-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N1CCN(CC1)C(=O)OCC |r|
Structure:
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