Reaction Details |
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Target | P2X purinoceptor 2/3 |
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Ligand | BDBM86478 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1924238 (CHEMBL4427194) |
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Ki | 9.0±n/a nM |
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Citation | Szántó, G; Makó, A; Bata, I; Farkas, B; Kolok, S; Vastag, M; Cselenyák, A New P2X3 receptor antagonists. Part 1: Discovery and optimization of tricyclic compounds. Bioorg Med Chem Lett26:3896-904 (2016) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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P2X purinoceptor 2/3 |
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Name: | P2X purinoceptor 2/3 |
Synonyms: | P2X2/3 | P2X2/P2X3 heterotrimeric receptor |
Type: | Protein |
Mol. Mass.: | n/a |
Description: | n/a |
Components: | This complex has 2 components. |
Component 1 |
Name: | P2X purinoceptor 2 |
Synonyms: | ATP receptor | P2RX2 | P2RX2_HUMAN | P2X2 | Purinergic receptor | PurinergicP2X2/3 |
Type: | Enzyme Catalytic Domain |
Mol. Mass.: | 51765.18 |
Organism: | Homo sapiens (Human) |
Description: | PurinergicP2X2/3 0 HUMAN::Q9UBL9 |
Residue: | 471 |
Sequence: | MAAAQPKYPAGATARRLARGCWSALWDYETPKVIVVRNRRLGVLYRAVQLLILLYFVWYV
FIVQKSYQESETGPESSIITKVKGITTSEHKVWDVEEYVKPPEGGSVFSIITRVEATHSQ
TQGTCPESIRVHNATCLSDADCVAGELDMLGNGLRTGRCVPYYQGPSKTCEVFGWCPVED
GASVSQFLGTMAPNFTILIKNSIHYPKFHFSKGNIADRTDGYLKRCTFHEASDLYCPIFK
LGFIVEKAGESFTELAHKGGVIGVIINWDCDLDLPASECNPKYSFRRLDPKHVPASSGYN
FRFAKYYKINGTTTRTLIKAYGIRIDVIVHGQAGKFSLIPTIINLATALTSVGVGSFLCD
WILLTFMNKNKVYSHKKFDKVCTPSHPSGSWPVTLARVLGQAPPEPGHRSEDQHPSPPSG
QEGQQGAECGPAFPPLRPCPISAPSEQMVDTPASEPAQASTPTDPKGLAQL
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Component 2 |
Name: | P2X purinoceptor 3 |
Synonyms: | ATP receptor | Glucocorticoid receptor | P2RX3 | P2RX3_HUMAN | P2X purinoceptor 3 | P2X purinoceptor 3 (P2RX3) | P2X purinoceptor 3 (P2X3) | P2X3 | P2X3 purinoceptor | Purinergic receptor | p2x3 + hsa |
Type: | Protein |
Mol. Mass.: | 44292.02 |
Organism: | Homo sapiens (Human) |
Description: | P56373 |
Residue: | 397 |
Sequence: | MNCISDFFTYETTKSVVVKSWTIGIINRVVQLLIISYFVGWVFLHEKAYQVRDTAIESSV
VTKVKGSGLYANRVMDVSDYVTPPQGTSVFVIITKMIVTENQMQGFCPESEEKYRCVSDS
QCGPERLPGGGILTGRCVNYSSVLRTCEIQGWCPTEVDTVETPIMMEAENFTIFIKNSIR
FPLFNFEKGNLLPNLTARDMKTCRFHPDKDPFCPILRVGDVVKFAGQDFAKLARTGGVLG
IKIGWVCDLDKAWDQCIPKYSFTRLDSVSEKSSVSPGYNFRFAKYYKMENGSEYRTLLKA
FGIRFDVLVYGNAGKFNIIPTIISSVAAFTSVGVGTVLCDIILLNFLKGADQYKAKKFEE
VNETTLKIAALTNPVYPSDQTTAEKQSTDSGAFSIGH
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BDBM86478 |
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n/a |
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Name | BDBM86478 |
Synonyms: | A-317491 |
Type | Small organic molecule |
Emp. Form. | C33H27NO8 |
Mol. Mass. | 565.5694 |
SMILES | OC(=O)c1cc(C(O)=O)c(cc1C(O)=O)C(=O)N(Cc1cccc(Oc2ccccc2)c1)[C@H]1CCCc2ccccc12 |
Structure |
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