MRS4654 [Ligand Id: 14170] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL4864408 |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Kv11.1/HERG in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809] | ||||||||
| ChEMBL | Inhibition of full length human ERG expressed in CHO cells by patch-clamp method | B | 4.52 | pIC50 | >30000 | nM | IC50 | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| P2Y14 receptor in Human [GtoPdb: 330] [UniProtKB: Q15391] | ||||||||
| GtoPdb | - | - | 7.82 | pIC50 | 15 | nM | IC50 | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| P2Y14 receptor/P2Y purinoceptor 14 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1770046] [GtoPdb: 330] [UniProtKB: Q9ESG6] | ||||||||
| ChEMBL | Inhibition of fluorescent antagonist binding to mouse P2Y14 receptor expressed in HEK293 cells preincubated with compound for 30 mins followed by fluorescent antagonist addition and measured after 30 mins by flow cytometry analysis | B | 7.73 | pIC50 | 18.6 | nM | IC50 | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| P2Y14 receptor/Purinergic receptor P2Y14 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4518] [GtoPdb: 330] [UniProtKB: Q15391] | ||||||||
| GtoPdb | - | - | 7.82 | pIC50 | 15 | nM | IC50 | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| ChEMBL | Inhibition of fluorescent antagonist binding to human P2Y14 receptor expressed in CHO cells preincubated with compound for 30 mins followed by fluorescent antagonist addition and measured after 30 mins by flow cytometry analysis | B | 7.82 | pIC50 | 15 | nM | IC50 | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| σ2/Sigma intracellular receptor 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4105907] [GtoPdb: 2553] [UniProtKB: Q5BJF2] | ||||||||
| ChEMBL | Binding affinity to sigma 2 receptor (unknown origin) | B | 5.32 | pKi | 4780 | nM | Ki | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| sigma non-opioid intracellular receptor 1/Sigma opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL287] [GtoPdb: 2552] [UniProtKB: Q99720] | ||||||||
| ChEMBL | Binding affinity to sigma 1 receptor (unknown origin) | B | 5.57 | pKi | 2680 | nM | Ki | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
| Translocator protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5742] [GtoPdb: 2879] [UniProtKB: P30536] | ||||||||
| ChEMBL | Binding affinity to TSPO (unknown origin) | B | 5.33 | pKi | 4630 | nM | Ki | J Med Chem (2021) 64: 5099-5122 [PMID:33787273] |
ChEMBL data shown on this page come from version 35:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
