BindingDB

null

SMILES CN([C@@H](Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2cnccc12

InChI Key InChIKey=RJVLFQBBRSMWHX-DHUJRADRSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50087267

P2X purinoceptor 7(Homo sapiens (Human))
AstraZeneca

Curated by ChEMBL

BDBM50087267((1-(N,O-bis(1,5-isoquinolinesulfonyl)-N-methyl-L-t...)copy SMILEScopy InChI

IC50: 12.6nMAssay Description:Antagonist activity at P2X7 receptor in human lymphocytes assessed as inhibition of ATP-induced Ba2+ influxMore data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
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BindingDB Entry DOI: 10.7270/Q2251KDRPubMed

P2X purinoceptor 7(Homo sapiens (Human))
AstraZeneca

Curated by ChEMBL

BDBM50087267((1-(N,O-bis(1,5-isoquinolinesulfonyl)-N-methyl-L-t...)copy SMILEScopy InChI

IC50: 50.1nMAssay Description:Antagonist activity at human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced calcium influxMore data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar

Purchase CHEMBL MCE
PC cid PC sid Patents Similars

Details Article
BindingDB Entry DOI: 10.7270/Q2251KDRPubMed

Targets 5 ▿
- P2X purinoceptor 7 29
- Calcium/calmodulin-dependent protein kinase type II subunit alpha 1
- P2X purinoceptor 4 1
- P2X purinoceptor 1
- p2X7 purinoceptor 1
Publications 19 ▿
- Bioorg Med Chem Lett 25: 3164-7 (2015) 4
- J Med Chem 58: 2114-34 (2015) 4
- Eur J Med Chem 151: 462-481 (2018) 3
- Eur J Med Chem 106: 180-93 (2015) 3
- J Med Chem 52: 3123-41 (2009) 2
- Eur J Med Chem 70: 811-30 (2013) 2
- J Med Chem 45: 4057-93 (2002) 2
- J Med Chem 55: 3687-98 (2012) 2
- Bioorg Med Chem 22: 54-88 (2014) 1
- J Med Chem 63: 1313-1327 (2020) 1
- Bioorg Med Chem Lett 19: 954-8 (2009) 1
- Bioorg Med Chem Lett 19: 6053-8 (2009) 1
- J Med Chem 46: 1318-29 (2003) 1
- Bioorg Med Chem Lett 18: 571-5 (2008) 1
- Bioorg Med Chem 17: 4861-5 (2009) 1
- Bioorg Chem 61: 58-65 (2015) 1
- Bioorg Med Chem Lett 13: 4047-50 (2003) 1
- Bioorg Med Chem Lett 10: 681-4 (2000) 1
- Bioorg Med Chem Lett 27: 759-763 (2017) 1
Institutions 14 ▿
- [Gwangju Institute of Science and Technology (GIST)] 14
- [University of Leeds] 4
- [National Institute of Diabetes, Università di Ferrara, AstraZeneca] 2
- [National Institute of Diabetes, Università di Ferrara, AstraZeneca] 2
- [National Institute of Diabetes, Università di Ferrara, AstraZeneca] 2
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
- [AstraZeneca R&D Charnwood, National Taiwan Normal University, Punjabi University, Institute of Science and Technology, Institute of Science& Technology, Universitat de Barcelona, Institute of Science and Technology (GIST), University of Sydney, Gwangju Institute of Science and Technology] 1
Affinity: 10 to 1.0E+5 nM▿
- IC50 31
- EC50 2
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 1