Detailed information for compound 1031615

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 299.798 | Formula: C17H18ClN3
  • H donors: 1 H acceptors: 0 LogP: 3.5 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1ccc(cc1)N1C(Cc2c1cccc2)C1=NCCN1.Cl
  • InChi: 1S/C17H17N3.ClH/c1-2-7-14(8-3-1)20-15-9-5-4-6-13(15)12-16(20)17-18-10-11-19-17;/h1-9,16H,10-12H2,(H,18,19);1H
  • InChiKey: ONOWDNCFSNEQJJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Adrenergic receptor alpha-1 Starlite/ChEMBL References
Rattus norvegicus Adrenergic receptor alpha-2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus biogenic amine 5HT receptor Adrenergic receptor alpha-2   450 aa 423 aa 31.7 %
Echinococcus multilocularis fmrfamide receptor Adrenergic receptor alpha-2   450 aa 366 aa 19.9 %
Echinococcus multilocularis alpha 1A adrenergic receptor Adrenergic receptor alpha-2   450 aa 478 aa 20.7 %
Echinococcus multilocularis serotonin receptor Adrenergic receptor alpha-2   450 aa 426 aa 31.9 %
Loa Loa (eye worm) TYRA-2 protein Adrenergic receptor alpha-2   450 aa 488 aa 23.8 %
Echinococcus granulosus alpha 1A adrenergic receptor Adrenergic receptor alpha-2   450 aa 476 aa 21.0 %
Schistosoma japonicum ko:K04145 dopamine receptor D2, putative Adrenergic receptor alpha-2   450 aa 473 aa 24.1 %
Schistosoma mansoni amine GPCR Adrenergic receptor alpha-2   450 aa 439 aa 29.2 %
Onchocerca volvulus Adrenergic receptor alpha-2   450 aa 420 aa 19.8 %
Echinococcus multilocularis neuropeptides capa receptor Adrenergic receptor alpha-2   450 aa 486 aa 20.6 %
Schistosoma mansoni biogenic amine (5HT) receptor Adrenergic receptor alpha-2   450 aa 433 aa 27.9 %
Onchocerca volvulus Adrenergic receptor alpha-2   450 aa 467 aa 25.1 %
Schistosoma japonicum ko:K04207 neuropeptide Y receptor Y5, putative Adrenergic receptor alpha-2   450 aa 378 aa 20.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium ulcerans hypothetical protein 0.0024 0.0034 0.0424
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0053 0.0349
Brugia malayi Pre-SET motif family protein 0.0415 0.1557 0.2144
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.009 0.0593
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0057 0.0164 0.103
Echinococcus multilocularis cpg binding protein 0.0032 0.0066 0.0419
Schistosoma mansoni zinc finger protein 0.0021 0.0023 0.0149
Loa Loa (eye worm) hypothetical protein 0.0024 0.0034 0.0206
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0052 0.0322
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0016
Loa Loa (eye worm) jmjC domain-containing protein 0.0038 0.009 0.0565
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0034 0.5
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0034 0.0424
Schistosoma mansoni ap endonuclease 0.0018 0.0013 0.0088
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0023 0.0135
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0023 0.0132
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0053 0.0323
Schistosoma mansoni cpg binding protein 0.0028 0.0052 0.0344
Brugia malayi hypothetical protein 0.005 0.0135 0.0183
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0023 0.0028
Schistosoma mansoni bromodomain containing protein 0.0064 0.019 0.1249
Onchocerca volvulus 0.0472 0.178 0.1761
Trypanosoma cruzi PAB1-binding protein , putative 0.005 0.0135 0.0504
Schistosoma mansoni hypothetical protein 0.0034 0.0073 0.048
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0013 0.005
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0023 0.0028
Echinococcus granulosus geminin 0.0167 0.0591 0.3743
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0105 0.0352 0.2227
Echinococcus granulosus jumonji domain containing protein 0.004 0.0097 0.0601
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0077 0.024 0.1567
Echinococcus multilocularis geminin 0.0167 0.0591 0.387
Loa Loa (eye worm) hypothetical protein 0.0018 0.0011 0.0055
Onchocerca volvulus 0.0028 0.0052 0.003
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0023 0.0151
Giardia lamblia Telomerase catalytic subunit 0.0705 0.2689 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0034 0.1158
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0118 0.0776
Schistosoma mansoni hypothetical protein 0.002 0.002 0.0134
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.0423 0.2705
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0023 0.0135
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0013 0.001
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0013 0.005
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0023 0.0135
Loa Loa (eye worm) PHD-finger family protein 0.002 0.002 0.0116
Echinococcus multilocularis zinc finger protein 0.0021 0.0023 0.0134
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.0176 0.1145
Echinococcus multilocularis jumonji domain containing protein 0.004 0.0097 0.0621
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0108 0.0401
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0053 0.0148
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0105 0.0352 0.2302
Schistosoma mansoni ap endonuclease 0.0018 0.0013 0.0088
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0007 0.0028
Schistosoma mansoni hypothetical protein 0.0085 0.0271 0.1779
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0007 0.0029
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0023 0.0132
Brugia malayi hypothetical protein 0.0032 0.0067 0.0089
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0034 0.0044
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0118 0.0776
Brugia malayi steroid hormone receptor 0.0021 0.0023 0.0028
Echinococcus multilocularis lysine specific demethylase 5A 0.0035 0.0077 0.0488
Mycobacterium ulcerans hypothetical protein 0.016 0.0565 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0144 0.0502 0.1866
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0023 0.0131
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0016
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Plasmodium falciparum ataxin-2 like protein, putative 0.005 0.0135 0.0465
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0011 0.0068
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.0502 0.1866
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.006 0.0175 0.0605
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0023 0.0151
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0034 0.0424
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0194 0.1262
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0023 0.0028
Loa Loa (eye worm) hypothetical protein 0.0038 0.0088 0.0553
Echinococcus granulosus histone lysine methyltransferase setb 0.0077 0.024 0.1515
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.1126 0.4186
Echinococcus multilocularis thyroid hormone receptor alpha 0.0021 0.0023 0.0135
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0023 0.0132
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0034 0.0424
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0023 0.0135
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0023 0.0135
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0013 0.0071
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0705 0.2689 1
Echinococcus granulosus peregrin 0.0031 0.0062 0.038
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0705 0.2689 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0013 0.007
Loa Loa (eye worm) hypothetical protein 0.0049 0.0133 0.0839
Mycobacterium tuberculosis Conserved hypothetical protein 0.016 0.0565 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0094 0.0307 0.2005
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0105 0.0352 0.0483
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.009 0.0593
Brugia malayi F/Y-rich N-terminus family protein 0.0022 0.0028 0.0035
Leishmania major mitochondrial DNA polymerase beta 0.0304 0.1126 0.4186
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0118 0.0737
Echinococcus multilocularis dnaJ subfamily B 0.0406 0.1522 1
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0023 0.0151
Echinococcus granulosus lysine specific demethylase 5A 0.0038 0.009 0.0559
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0023 0.0028
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0023 0.0132
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0007 0.0044
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0053 0.0158
Schistosoma mansoni hypothetical protein 0.0167 0.0591 0.388
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0023 0.0151
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0108 0.0401
Loa Loa (eye worm) hypothetical protein 0.0018 0.0011 0.0055
Plasmodium falciparum ataxin-2 like protein, putative 0.005 0.0135 0.0465
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0034 0.0128
Onchocerca volvulus 0.0024 0.0034 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0105 0.0352 0.0483
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0013 0.5
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0034 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0134 0.0182
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0013 0.0073
Brugia malayi jmjC domain containing protein 0.0094 0.0307 0.042
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0194 0.0722
Schistosoma mansoni hypothetical protein 0.0022 0.0028 0.0187
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0022 0.0028 0.0171
Loa Loa (eye worm) hypothetical protein 0.005 0.0135 0.0856
Brugia malayi PHD-finger family protein 0.0026 0.0043 0.0056
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0088 0.0543
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0023 0.0028
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0023 0.0131
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.006 0.0175 0.1137
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0108 0.0401
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0034 0.0424
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0023 0.0131
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0108 0.0401
Echinococcus multilocularis peregrin 0.0031 0.0062 0.0393
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0009 0.0043
Onchocerca volvulus 0.006 0.0175 0.0153
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0023 0.0151
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0034 0.0202
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0013 0.0015
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0077 0.024 0.158
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0034 0.1158
Toxoplasma gondii LsmAD domain-containing protein 0.005 0.0135 0.0456
Echinococcus granulosus FTZ F1 alpha 0.0419 0.1574 1
Leishmania major hypothetical protein, conserved 0.005 0.0135 0.0504
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0023 0.0151
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0304 0.1126 0.4186
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.0423 0.2705
Brugia malayi MH2 domain containing protein 0.0124 0.0423 0.058
Toxoplasma gondii RNA-directed DNA polymerase 0.0705 0.2689 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0013 0.0046
Plasmodium vivax ataxin-2 like protein, putative 0.005 0.0135 0.0465
Loa Loa (eye worm) hypothetical protein 0.0077 0.024 0.1532
Echinococcus granulosus zinc finger protein 0.0021 0.0023 0.0129
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0013 0.0114
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0194 0.1234
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0134 0.0847
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0034 0.0424
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0023 0.0151
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0118 0.016
Brugia malayi Bromodomain containing protein 0.0038 0.0088 0.0118
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0034 0.0044
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0014 0.0092
Brugia malayi CXXC zinc finger family protein 0.0028 0.0052 0.0069
Echinococcus granulosus dnaJ subfamily B 0.0406 0.1522 0.9671
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.0194 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0073 0.0455
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0023 0.0028
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0118 0.0737
Brugia malayi Bromodomain containing protein 0.0031 0.0062 0.0082
Trypanosoma brucei telomerase reverse transcriptase 0.0705 0.2689 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0034 0.0206
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0016
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0194 0.0722
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0023 0.0131
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0023 0.0028
Trichomonas vaginalis set domain proteins, putative 0.0472 0.178 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0034 0.0489
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0023 0.0135
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0023 0.0131
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0034 0.0424
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0023 0.0028
Brugia malayi jmjC domain containing protein 0.0038 0.009 0.0121
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0194 0.1221
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Giardia lamblia PHD finger protein 15 0.0029 0.0053 0.0148
Schistosoma mansoni hypothetical protein 0.0167 0.0591 0.388
Schistosoma mansoni cpg binding protein 0.0032 0.0066 0.0434
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0194 0.0722
Loa Loa (eye worm) hypothetical protein 0.0029 0.0053 0.0326
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0023 0.0151
Plasmodium vivax telomerase reverse transcriptase, putative 0.0705 0.2689 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0034 0.0209
Loa Loa (eye worm) hypothetical protein 0.0152 0.0534 0.3419
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0053 0.0334
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0023 0.0151
Loa Loa (eye worm) hypothetical protein 0.0049 0.0134 0.0847
Loa Loa (eye worm) hypothetical protein 0.007 0.0212 0.135
Leishmania major telomerase reverse transcriptase, putative 0.0705 0.2689 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0118 0.0745
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.0172 0.1091
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0013 0.001
Schistosoma mansoni coup transcription factor 0.0021 0.0023 0.0151
Brugia malayi PHD-finger family protein 0.0029 0.0053 0.007
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0194 0.0265
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0023 0.0151
Schistosoma mansoni hypothetical protein 0.0406 0.1522 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0022 0.0028 0.0166
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0023 0.0028
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0144 0.0537
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.0176 0.1107
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0077 0.024 0.158
Loa Loa (eye worm) hypothetical protein 0.0024 0.0034 0.0206
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0011 0.5
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0194 0.0722
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0023 0.0028
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0118 0.0762
Plasmodium vivax SET domain protein, putative 0.006 0.0175 0.0614
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0175 0.1151
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0118 0.0776
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0094 0.0307 0.1939
Loa Loa (eye worm) hypothetical protein 0.0105 0.0352 0.2251
Brugia malayi Bromodomain containing protein 0.0075 0.0235 0.0321
Loa Loa (eye worm) hypothetical protein 0.0018 0.0011 0.0055
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0105 0.0352 0.2314
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0023 0.0132
Toxoplasma gondii hypothetical protein 0.0049 0.0132 0.0445
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0013 0.005
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0023 0.0131
Loa Loa (eye worm) hypothetical protein 0.0018 0.0011 0.0055
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0034 0.0489
Onchocerca volvulus 0.0152 0.0534 0.0512
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.006 0.0175 0.1151
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0023 0.0132
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0118 0.0762
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.0169 0.0582
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0023 0.0131
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0088 0.0562
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0079 0.0504
Brugia malayi nuclear receptor NHR-88 0.0021 0.0023 0.0028
Schistosoma mansoni jumonji domain containing protein 0.0075 0.0232 0.1524
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.0502 0.1866
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0415 0.1557 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0185 0.1218
Loa Loa (eye worm) hypothetical protein 0.0044 0.0111 0.0699
Loa Loa (eye worm) hypothetical protein 0.0021 0.0023 0.0132
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0013 0.5
Loa Loa (eye worm) hypothetical protein 0.004 0.0097 0.0611
Echinococcus multilocularis FTZ F1 alpha 0.0105 0.0352 0.2302
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0023 0.0151
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0034 0.0128
Schistosoma mansoni cpg binding protein 0.0032 0.0066 0.0434
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0079 0.0488
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0023 0.0028
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0023 0.0028
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0013 0.005
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0134 0.0182
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0034 0.0424
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.0034 0.1158
Plasmodium falciparum phd finger protein, putative 0.0029 0.0053 0.0158
Loa Loa (eye worm) hypothetical protein 0.0018 0.0011 0.0055
Schistosoma mansoni hypothetical protein 0.0029 0.0053 0.0349
Echinococcus granulosus cpg binding protein 0.0032 0.0066 0.0405
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0016
Brugia malayi ecdysteroid receptor 0.0021 0.0023 0.0028
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0007 0.0044
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0053 0.0148
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0034 0.0044
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0023 0.0132
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0034 0.0128
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0034 0.0224
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0023 0.0028
Brugia malayi Pre-SET motif family protein 0.006 0.0175 0.0238
Trypanosoma cruzi PAB1-binding protein , putative 0.005 0.0135 0.0504
Brugia malayi Telomerase reverse transcriptase 0.1877 0.7253 1
Plasmodium falciparum telomerase reverse transcriptase 0.0705 0.2689 1
Trypanosoma brucei PAB1-binding protein , putative 0.005 0.0135 0.0504
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0194 0.1276
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0023 0.0028
Brugia malayi hypothetical protein 0.0152 0.0534 0.0733
Brugia malayi nuclear hormone receptor 0.0021 0.0023 0.0028
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0073 0.0098
Onchocerca volvulus Alhambra homolog 0.0029 0.0053 0.003
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0053 0.0326
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0023 0.0132
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.1126 0.4186

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 3 nM Inhibition of saturable binding of [3H]-idazoxan to alpha2-site in rat cerebral cortical membranes. ChEMBL. 2896247
Ki (binding) = 8.4 nM Inhibition of saturable binding of [3H]-prazosin to alpha1-site in rat cerebral cortical membranes. ChEMBL. 2896247
Postjunctional agonist potency (functional) = 5.3 Agonism at alpha-1 adrenergic receptor, determined as the dose required to produce a two fold shift of the cirazoline on diastolic blood pressure. ChEMBL. 2896247
Postjunctional antagonist potency (functional) Agonist potency towards alpha-2 adrenergic receptor determined as the dose required to produce a two fold shift of the cirazoline on diastolic blood pressure (in vitro) ChEMBL. 2896247
Prejunctional agonist potency (functional) = 0 Agonism at alpha-1 adrenergic receptor, determined as dose required to produce a two fold shift of the cumulative dose-response curve to UK-14,304 on the twitch response in rat vas deferens. ChEMBL. 2896247
Prejunctional antagonist potency (functional) = 0.5 Antagonism at alpha-2 adrenergic receptor, determined as dose required to produce a two fold shift of the dose-response curve to UK-14,304 on the twitch response in rat vas deferens ChEMBL. 2896247

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

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