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Target
P2X purinoceptor 7
Ligand
BDBM50359222
Substrate
n/a
Meas. Tech.
ChEMBL_790225 (CHEMBL1925618)
IC50
104±n/a nM
Citation
 Brumfield, S; Matasi, JJ; Tulshian, D; Czarniecki, M; Greenlee, W; Garlisi, C; Qiu, H; Devito, K; Chen, SC; Sun, Y; Bertorelli, R; Ansell, J; Geiss, W; Le, VD; Martin, GS; Vellekoop, SA; Haber, J; Allard, ML Synthesis and SAR development of novel P2X7 receptor antagonists for the treatment of pain: part 2. Bioorg Med Chem Lett 21:7287-90 (2011) [PubMed]  Article 
Target
Name:
P2X purinoceptor 7
Synonyms:
ATP receptor | P2RX7 | P2RX7_HUMAN | P2X purinoceptor 7 (P2RX7) | P2X purinoceptor 7 (P2X7) | P2X7 | P2Z receptor | Purinergic receptor
Type:
Protein
Mol. Mass.:
68602.85
Organism:
Homo sapiens (Human)
Description:
Q99572
Residue:
595
Sequence:
MPACCSCSDVFQYETNKVTRIQSMNYGTIKWFFHVIIFSYVCFALVSDKLYQRKEPVISSVHTKVKGIAEVKEEIVENGVKKLVHSVFDTADYTFPLQGNSFFVMTNFLKTEGQEQRLCPEYPTRRTLCSSDRGCKKGWMDPQSKGIQTGRCVVYEGNQKTCEVSAWCPIEAVEEAPRPALLNSAENFTVLIKNNIDFPGHNYTTRNILPGLNITCTFHKTQNPQCPIFRLGDIFRETGDNFSDVAIQGGIMGIEIYWDCNLDRWFHHCRPKYSFRRLDDKTTNVSLYPGYNFRYAKYYKENNVEKRTLIKVFGIRFDILVFGTGGKFDIIQLVVYIGSTLSYFGLAAVFIDFLIDTYSSNCCRSHIYPWCKCCQPCVVNEYYYRKKCESIVEPKPTLKYVSFVDESHIRMVNQQLLGRSLQDVKGQEVPRPAMDFTDLSRLPLALHDTPPIPGQPEEIQLLRKEATPRSRDSPVWCQCGSCLPSQLPESHRCLEELCCRKKPGACITTSELFRKLVLSRHVLQFLLLYQEPLLALDVDSTNSRLRHCAYRCYATWRFGSQDMADFAILPSCCRWRIRKEFPKSEGQYSGFKSPY
  
Inhibitor
Name:
BDBM50359222
Synonyms:
CHEMBL1923317
Type:
Small organic molecule
Emp. Form.:
C30H25F5N6O
Mol. Mass.:
580.5511
SMILES:
CCN1C2=NC(C)(C)CN2c2c(nc(-c3ccc(nc3)-c3cccc(c3)C(F)(F)F)n2Cc2ccc(F)c(F)c2)C1=O |t:3|
Structure:
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