NAN 190 [Ligand Id: 73] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL8618 (NAN-190)
  • α1A-adrenoceptor/Alpha-1a adrenergic receptor in Human [ChEMBL: CHEMBL229] [GtoPdb: 22] [UniProtKB: P35348]
  • 9.59
1 CHEMBL8618_lig_chart_1 Alpha-1a adrenergic receptor Human
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  • α1B-adrenoceptor/Alpha-1b adrenergic receptor in Human [ChEMBL: CHEMBL232] [GtoPdb: 23] [UniProtKB: P35368]
  • 9.11
2 CHEMBL8618_lig_chart_2 Alpha-1b adrenergic receptor Human
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  • α1D-adrenoceptor/Alpha-1d adrenergic receptor in Human [ChEMBL: CHEMBL223] [GtoPdb: 24] [UniProtKB: P25100]
  • 9.36
3 CHEMBL8618_lig_chart_3 Alpha-1d adrenergic receptor Human
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  • D2 receptor/Dopamine D2 receptor in Rat [ChEMBL: CHEMBL339] [GtoPdb: 215] [UniProtKB: P61169]
  • 7.35
4 CHEMBL8618_lig_chart_4 Dopamine D2 receptor Rat
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  • 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908]
  • 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Rat [ChEMBL: CHEMBL273] [GtoPdb: 1] [UniProtKB: P19327]
  • 9.22
5 CHEMBL8618_lig_chart_5 Serotonin 1a (5-HT1a) receptor HumanRat
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  • 5-HT1B receptor/Serotonin 1b (5-HT1b) receptor in Rat [ChEMBL: CHEMBL3459] [GtoPdb: 2] [UniProtKB: P28564]
  • This target only has 1 pki data point
  • 5.97
6 CHEMBL8618_lig_chart_6 Serotonin 1b (5-HT1b) receptor Rat
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  • 5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Human [ChEMBL: CHEMBL3155] [GtoPdb: 12] [UniProtKB: P34969]
  • 5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Rat [ChEMBL: CHEMBL3223] [GtoPdb: 12] [UniProtKB: P32305]
  • 7.06
7 CHEMBL8618_lig_chart_7 Serotonin 7 (5-HT7) receptor HumanRat
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  • 5-HT1F receptor in Human [GtoPdb: 5] [UniProtKB: P30939]
  • This target only has 1 pki data point
  • 6.7
8 CHEMBL8618_lig_chart_8 5-HT1F receptor Human
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
α1A-adrenoceptor/Alpha-1a adrenergic receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL229] [GtoPdb: 22] [UniProtKB: P35348]
ChEMBL Binding constant measured against Alpha-1A adrenergic receptor in human prostate; ++:moderately active B 8.7 pKi 2 nM Ki Bioorg. Med. Chem. Lett. (2005) 15: 657-664 [PMID:15664832]
ChEMBL Displacement of [125]HEAT from human adrenergic alpha-1a receptor expressed in CHO cells B 9.59 pKi 0.26 nM Ki Bioorg. Med. Chem. Lett. (2007) 17: 1646-1650 [PMID:17254786]
GtoPdb - - 10.1 pKi - - - Jpn J Pharmacol (2001) 86: 189-95 [PMID:11459121]
α1B-adrenoceptor/Alpha-1b adrenergic receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL232] [GtoPdb: 23] [UniProtKB: P35368]
ChEMBL Displacement of [125]HEAT from human adrenergic alpha-1b receptor expressed in CHO cells B 9.02 pKi 0.96 nM Ki Bioorg. Med. Chem. Lett. (2007) 17: 1646-1650 [PMID:17254786]
GtoPdb - - 9.2 pKi - - - Jpn J Pharmacol (2001) 86: 189-95 [PMID:11459121]
α1D-adrenoceptor/Alpha-1d adrenergic receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL223] [GtoPdb: 24] [UniProtKB: P25100]
GtoPdb - - 9.2 pKi - - - Jpn J Pharmacol (2001) 86: 189-95 [PMID:11459121]
ChEMBL Displacement of [125]HEAT from human adrenergic alpha-1d receptor expressed in CHO cells B 9.52 pKi 0.3 nM Ki Bioorg. Med. Chem. Lett. (2007) 17: 1646-1650 [PMID:17254786]
D2 receptor/Dopamine D2 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL339] [GtoPdb: 215] [UniProtKB: P61169]
ChEMBL Compound was evaluated for binding affinity against Dopamine receptor D2 using [3H]raclopride as a radioligand B 7.19 pKi 64 nM Ki Bioorg. Med. Chem. Lett. (1996) 6: 689-694
ChEMBL Binding affinity towards dopamine receptor D2 using [3H]-raclopride radioligand. B 7.19 pKi 64 nM Ki J. Med. Chem. (1996) 39: 4439-4450 [PMID:8893838]
ChEMBL In vitro binding affinity towards Dopamine receptor D2 in rat striatum was determined using [3H]spiperone as radioligand B 7.5 pKi 31.62 nM Ki J. Med. Chem. (1995) 38: 4044-4055 [PMID:7562940]
ChEMBL In vitro ability to inhibit binding of radioligand [3H]spiroperidol to dopamine D2 receptor in rat striatal membranes B 8.02 pKi 9.55 nM Ki J. Med. Chem. (1994) 37: 99-104 [PMID:8289207]
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908]
ChEMBL Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor transfected in CFO-K1 cells after 30 mins by liquid scintillation spectrometry B 7.06 pKi 87 nM Ki Eur. J. Med. Chem. (2014) 85: 716-726 [PMID:25128671]
ChEMBL Displacement of [3H]8-OH-DPAT from human recombinant 5HT1A receptor expressed in HEK293 cells after 120 mins B 9.22 pKi 0.6 nM Ki J. Med. Chem. (2009) 52: 7892-7896 [PMID:19705871]
GtoPdb - - 9.4 pKi - - - Eur J Pharmacol (1998) 355: 245-56 [PMID:9760039]
ChEMBL Antagonist activity at human 5-HT1A receptor expressed in CHO-K1 cells assessed as inhibition of serotonin-induced calcium mobilization preincubated for 25 mins followed by serotonin induction measured for 30 secs by aequorin-derived luminescence assay F 8.3 pIC50 5 nM IC50 Eur J Med Chem (2017) 137: 108-116 [PMID:28575721]
ChEMBL Antagonist activity at human 5-HT1A receptor expressed in CHO-K1 cells co-expressing Galpha16 assessed as decrease in serotonin calcium mobilization preincubated for 25 mins followed by serotonin challenge measured for 30 secs by aequorin-derived luminescence assay F 8.33 pIC50 4.73 nM IC50 Bioorg Med Chem Lett (2018) 28: 2039-2049 [PMID:29730027]
ChEMBL Antagonist activity at human recombinant 5-HT1A receptor expressed in CHOK1 cells incubated for 25 mins followed by addition of methiothepin by microbeta2 scintillation counter B 8.95 pIC50 1.12 nM IC50 Bioorg Med Chem (2019) 27: 4163-4173 [PMID:31383628]
ChEMBL Antagonist activity at human recombinant 5-HT1A receptor expressed in CHOK1 cells incubated for 25 mins followed by addition of methiothepin by microbeta2 scintillation counter B 8.96 pIC50 1.1 nM IC50 Bioorg Med Chem (2019) 27: 4163-4173 [PMID:31383628]
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL273] [GtoPdb: 1] [UniProtKB: P19327]
ChEMBL In vitro ability to inhibit binding of radioligand [3H]8-OH-DPAT to 5-hydroxytryptamine 1A receptor in rat cerebral cortex B 8.88 pKi 1.32 nM Ki J. Med. Chem. (1994) 37: 99-104 [PMID:8289207]
ChEMBL In vitro ability to displace [3H]8-OH-DPAT from 5-hydroxytryptamine 1A receptor sites of rat brain cortex. B 8.9 pKi 1.26 nM Ki J. Med. Chem. (1995) 38: 1273-1277 [PMID:7731013]
ChEMBL Binding affinity at 5-hydroxytryptamine 1A receptor B 9.15 pKi 0.71 nM Ki J. Med. Chem. (1995) 38: 4044-4055 [PMID:7562940]
ChEMBL Binding affinity of a compound to rat brain 5-hydroxytryptamine 1A (serotonin) receptor assayed by radiolabeled [3H]-8-OH-DPAT ligand displacement B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1996) 39: 126-134 [PMID:8568799]
ChEMBL In vitro binding affinity for 5-hydroxytryptamine 1A receptor in rat hippocampal membranes by [125I]-labeled agonist displacement. B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1998) 41: 157-166 [PMID:9457239]
ChEMBL In vitro binding affinity to 5-hydroxytryptamine 1A receptor using [125I](R)-(+)-trans-8-OH-PIPAT as radioligand in rat hippocampal homogenate B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1994) 37: 4572-4575 [PMID:7799409]
ChEMBL Binding affinity towards 5-hydroxytryptamine 1A receptor using 0.1 nM [3H]-8-OH-DPAT (8-hydroxy-2-(di-n-propylamino)tet-ralin), from rat hippocampal homogenate B 9.22 pKi 0.6 nM Ki Bioorg. Med. Chem. Lett. (1998) 8: 2467-2472 [PMID:9873563]
ChEMBL Binding affinity towards 5-hydroxytryptamine 1A receptor of rat hippocampus using [3H]-8-hydroxy-2-(di-n-propylamine) tetralin (8-OH-DPAT) as a radioligand B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1991) 34: 2633-2638 [PMID:1652026]
ChEMBL Binding affinity towards rat 5-hydroxytryptamine 1A receptor using [3H]8-OH-DPAT radioligand. B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1996) 39: 4439-4450 [PMID:8893838]
ChEMBL Binding affinity towards 5-hydroxytryptamine 1A receptor in the rat brain (hippocampus) using [3H]8-OH-DPAT B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1996) 39: 1125-1129 [PMID:8676348]
ChEMBL Binding affinity of compound towards 5-hydroxytryptamine 1A receptor in rat striatal membranes by [3H]OH-DPAT displacement. B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1989) 32: 1921-1926 [PMID:2754715]
ChEMBL Inhibition of binding of [125I]8-OH-PIPAT ligand to 5-hydroxytryptamine 1A receptor of rat hippocampal homogenates B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1994) 37: 1406-1407 [PMID:8182697]
ChEMBL In vitro ability to displace the radioligand [3H]-OH-DPAT from binding to rat 5-hydroxytryptamine 1A receptor B 9.22 pKi 0.6 nM Ki Bioorg. Med. Chem. Lett. (2004) 14: 5863-5866 [PMID:15501057]
ChEMBL Evaluated for binding affinity towards 5-hydroxytryptamine 1A receptor in rat brain B 9.22 pKi 0.6 nM Ki J. Med. Chem. (1988) 31: 1968-1971 [PMID:3172131]
ChEMBL Binding affinity at 5-hydroxytryptamine 1A receptor in rat cerebral cortex membranes by [3H]8-OH-DPAT displacement. B 9.22 pKi 0.6 nM Ki Bioorg. Med. Chem. Lett. (1996) 6: 689-694
ChEMBL Binding affinity at 5-hydroxytryptamine 1A receptor in rat cerebral cortex membranes by [3H]8-OH-DPAT displacement. B 9.22 pKi 0.6 nM Ki Bioorg. Med. Chem. Lett. (1996) 6: 689-694
ChEMBL Ability to displace [3H]8-OH-DPAT from 5-hydroxytryptamine 1A receptor B 9.26 pKi 0.55 nM Ki J. Med. Chem. (1999) 42: 4952-4960 [PMID:10585205]
5-HT1B receptor/Serotonin 1b (5-HT1b) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3459] [GtoPdb: 2] [UniProtKB: P28564]
ChEMBL Binding affinity at 5-hydroxytryptamine 1B receptor B 5.97 pKi 1071.52 nM Ki J. Med. Chem. (1995) 38: 4044-4055 [PMID:7562940]
5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3155] [GtoPdb: 12] [UniProtKB: P34969]
ChEMBL Displacement of [3H]5-HT from human 5HT7 receptor transfected in CFO-K1 cells after 30 mins by liquid scintillation spectrometry B 9.22 pKi 0.6 nM Ki Eur. J. Med. Chem. (2014) 85: 716-726 [PMID:25128671]
5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3223] [GtoPdb: 12] [UniProtKB: P32305]
ChEMBL In vitro ability to displace the radioligand [3H]5-CT from binding to rat 5-hydroxytryptamine 7 receptor B 7.06 pKi 87 nM Ki Bioorg. Med. Chem. Lett. (2004) 14: 5863-5866 [PMID:15501057]
5-HT1F receptor in Human [GtoPdb: 5] [UniProtKB: P30939]
GtoPdb - - 6.7 pKi - - - Proc Natl Acad Sci USA (1993) 90: 408-12 [PMID:8380639]

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]