ketamine [Ligand Id: 4233] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL742 (Anaket v, Calypsol, Clorketam 1000, Dl-ketamine, Imalgene 1000, Ketalar, Ketamine, Ketasol 100, Narketan, NSC-70151, PMI-150, Tekam, Ursotamin, Vetaket) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Acetylcholine receptor protein alpha chain in Torpedo californica (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3097] [UniProtKB: P02710] | ||||||||
| ChEMBL | Displacement of [3H]PCP from nAChR in Torpedo nobiliana electric organs membranes by scintillation counting method | B | 4.95 | pIC50 | 11100 | nM | IC50 | J Pestic Sci (1995) 20: 49-56 |
| ChEMBL | Displacement of [3H]PCP from nAChR in Torpedo nobiliana electric organs membranes in presence of 100 uM carbachol by scintillation counting method | B | 5.31 | pIC50 | 4950 | nM | IC50 | J Pestic Sci (1995) 20: 49-56 |
| Acetylcholinesterase in Electrophorus electricus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4078] [UniProtKB: O42275] | ||||||||
| ChEMBL | Inhibition of electric eel AChE by modified Ellman's method | B | 5 | pIC50 | >10000 | nM | IC50 | J Med Chem (2010) 53: 3611-3617 [PMID:20361801] |
| Cholinesterase in Equus caballus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5763] [UniProtKB: P81908] | ||||||||
| ChEMBL | Inhibition of equine serum BChE by modified Ellman's method | B | 5 | pIC50 | >10000 | nM | IC50 | J Med Chem (2010) 53: 3611-3617 [PMID:20361801] |
| GluN2D/GluN3B/GluN1/GluN2A/GluN2B/GluN2C/GluN3A/Glutamate [NMDA] receptor in Human (target type: PROTEIN COMPLEX GROUP) [ChEMBL: CHEMBL2094124] [GtoPdb: 459, 461, 455, 456, 457, 458, 460] [UniProtKB: O15399, O60391, Q05586, Q12879, Q13224, Q14957, Q8TCU5] | ||||||||
| ChEMBL | Binding affinity to NMDA receptor (unknown origin) | B | 5.72 | pKi | 1900 | nM | Ki | Bioorg Med Chem (2019) 27: 1226-1231 [PMID:30792105] |
| ChEMBL | The compound was tested for its ability to block PCP N-methyl-D-aspartate glutamate receptor at the PCP (phencyclidine) binding site in postmortem human frontal cortex. | B | 6.38 | pKi | 420 | nM | Ki | J Med Chem (1998) 41: 393-400 [PMID:9464369] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in human frontal cortex in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in human cortex incubated for 2 hrs in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| GtoPdb | Measured vs. exogenously expressed zeta1/epsilon3 (GRIN1/GRIN2C) subunits, at pH 6.9 | - | 6.18 | pIC50 | 660 | nM | IC50 | J Physiol (Lond.) (2007) 581: 107-28 [PMID:17303642] |
| GluN1/GluN2A/GluN2B/GluN2C/GluN2D/GluN3B/GluN3A in Human [GtoPdb: 455, 456, 457, 458, 459, 461, 460] [UniProtKB: Q05586, Q12879, Q13224, Q14957, O15399, O60391, Q8TCU5] | ||||||||
| GtoPdb | Measured vs. exogenously expressed zeta1/epsilon3 (GRIN1/GRIN2C) subunits, at pH 6.9 | - | 6.18 | pIC50 | 660 | nM | IC50 | J Physiol (Lond.) (2007) 581: 107-28 [PMID:17303642] |
| GluN1/GluN2A/GluN2B/GluN2C/GluN2D/GluN3B/GluN3A/Glutamate NMDA receptor in Rat (target type: PROTEIN COMPLEX GROUP) [ChEMBL: CHEMBL1907608] [GtoPdb: 455, 456, 457, 458, 459, 461, 460] [UniProtKB: P35439, Q00959, Q00960, Q00961, Q62645, Q8VHN2, Q9R1M7] | ||||||||
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat whole brain homogenate incubated for 2 hrs in presence of Mg2+ by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat brain membranes incubated for 2 hrs in presence of Mg2+ by radioligand binding assay | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat brain membranes incubated for 60 mins in presence of Mg2+ by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in Sprague-Dawley rat cerebral cortex by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat brain membranes incubated for 45 mins in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-TCP from NMDA receptor in rat brain membranes incubated for 45 mins in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat brain membranes incubated for 2 hrs in presence of Mg2+/glumate/glycine by radioligand binding assay | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat spinal cord incubated for 45 mins by liquid scintillation spectrometry | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in Sprague-Dawley rat cerebellum by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in Sprague-Dawley rat brain synaptic membrane incubated for 60 mins by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat striatum incubated for 2 hrs in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in Sprague-Dawley rat cortex incubated for 2 hrs in presence of Mg2+ by scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Displacement of [3H]-MK801 from NMDA receptor in rat forebrain homogenate incubated for 2 hrs in presence of Mg2+ by liquid scintillation counting method | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Inhibition of NMDAR-mediated excitatory postsynaptic potential in Sprague-Dawley rat hippocampus CA1 region by electrophysiology | B | 5 | pIC50 | 10000 | nM | IC50 | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Ability to inhibit glutamate induced accumulation of [45 [Ca2+]] in cultured rat cortical neurons | F | 5.05 | pIC50 | 8860 | nM | IC50 | J Med Chem (1993) 36: 1977-1995 [PMID:8336337] |
| ChEMBL | Binding affinity towards PCP site of the NMDA receptor was measured by displacement of [3H]TPC in whole rat brain homogenate | B | 6.07 | pIC50 | 860 | nM | IC50 | J Med Chem (1993) 36: 1977-1995 [PMID:8336337] |
| ChEMBL | Displacement of [3H] MK-801 from NMDA glutamate ion channel in Wistar rat brain membranes (minus cerebellum) after 3 hrs by scintillation counting analysis | B | 6.15 | pIC50 | 700 | nM | IC50 | Bioorg Med Chem (2019) 27: 1226-1231 [PMID:30792105] |
| ChEMBL | Inhibition of [3H]-MK-801 binding to NMDA receptor from rat cerebral cortical synaptic membrane | B | 6.21 | pIC50 | 610 | nM | IC50 | J Med Chem (1996) 39: 4844-4852 [PMID:8941398] |
| ChEMBL | Inhibition of [3H]MK-801 binding to N-methyl-D-aspartate glutamate receptor of rat cerebral cortical synaptic membrane | B | 6.21 | pIC50 | 610 | nM | IC50 | J Med Chem (1998) 41: 3507-3514 [PMID:9719604] |
| GluN1/GluN2A/Glutamate NMDA receptor; GRIN1/GRIN2A in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907604] [GtoPdb: 455, 456] [UniProtKB: Q05586, Q12879] | ||||||||
| ChEMBL | Displacement of [3H]-MK801 from human forebrain GluN1/GluN2B expressed in HEK293 cells by at -70 mV holding potential by patch-clamp assay | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| ChEMBL | Inhibition of dexamethasone-induced human NR1-1a/NR2A receptor-mediated excitotoxicity in (S)-glutamate/glycine-stimulated mouse L12-G10 cells assessed as LDH release after 30 mins | B | 5.21 | pIC50 | 6100 | nM | IC50 | J Med Chem (2010) 53: 3611-3617 [PMID:20361801] |
| ChEMBL | Antagonist activity at NR1/NR2A receptor (unknown origin) expressed in Xenopus laevis oocytes assessed as inhibition of glutamate/glycine-induced current at pH 7.6 at -40mV holding potential by two-electrode voltage-clamp electrophysiology | B | 5.48 | pIC50 | 3310 | nM | IC50 | Bioorg Med Chem (2014) 22: 1983-1992 [PMID:24630693] |
| ChEMBL | Inhibition of human recombinant NR1/NR2A receptor expressed in U2OS assessed as change in intracellular calcium level by FLIPR assay | B | 5.9 | pIC50 | 1258.93 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 2059-2063 [PMID:21334205] |
| GluN1/GluN2A/Glutamate NMDA receptor; Grin1/Grin2a in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2096680] [GtoPdb: 455, 456] [UniProtKB: P35439, Q00959] | ||||||||
| ChEMBL | Displacement of [3H]-MK801 from rat brain GluN1/GluN2A expressed in HEK293 cells | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| GluN1/GluN2B/Glutamate NMDA receptor; GRIN1/GRIN2B in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907603] [GtoPdb: 455, 457] [UniProtKB: Q05586, Q13224] | ||||||||
| ChEMBL | Inhibition of human recombinant NR1/NR2B receptor expressed in U2OS assessed as change in intracellular calcium level by FLIPR assay | B | 5.3 | pIC50 | 5011.87 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 2059-2063 [PMID:21334205] |
| ChEMBL | Inhibition of dexamethasone-induced human NR1-1a/NR2B receptor-mediated excitotoxicity in (S)-glutamate/glycine-stimulated mouse L13-E6 cells assessed as LDH release after 30 mins | B | 5.49 | pIC50 | 3200 | nM | IC50 | J Med Chem (2010) 53: 3611-3617 [PMID:20361801] |
| GluN1/GluN2B/Glutamate NMDA receptor; Grin1/Grin2b in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2096666] [GtoPdb: 455, 457] [UniProtKB: P35439, Q00960] | ||||||||
| ChEMBL | Displacement of [3H]-MK801 from rat brain GluN1/GluN2B expressed in HEK293 cells | B | 6.74 | pKi | 180 | nM | Ki | J Med Chem (2020) 63: 13514-13525 [PMID:32915563] |
| Cav1.2/Voltage-gated L-type calcium channel alpha-1C subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1940] [GtoPdb: 529] [UniProtKB: Q13936] | ||||||||
| ChEMBL | Inhibition of Cav1.2 calcium current measured using whole cell patch clamp in human atrial myocytes | F | 5.74 | pIC50 | 1800 | nM | IC50 | IC50 data for the L-type calcium channel extracted from a set of literature articles |
ChEMBL data shown on this page come from version 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
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]
