Detailed information for compound 1595821

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 495.465 | Formula: C23H28Cl2N4O2S
  • H donors: 1 H acceptors: 3 LogP: 4.93 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)N1CCN(CC1)CCCCNS(=O)(=O)c1ccc2c(c1)cccn2.Cl
  • InChi: 1S/C23H27ClN4O2S.ClH/c24-20-5-7-21(8-6-20)28-16-14-27(15-17-28)13-2-1-12-26-31(29,30)22-9-10-23-19(18-22)4-3-11-25-23;/h3-11,18,26H,1-2,12-17H2;1H
  • InChiKey: UZSSSWLPDKFKAQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens 5-hydroxytryptamine (serotonin) receptor 7, adenylate cyclase-coupled Starlite/ChEMBL References
Rattus norvegicus Serotonin 2a (5-HT2a) receptor Starlite/ChEMBL References
Homo sapiens 5-hydroxytryptamine (serotonin) receptor 6, G protein-coupled Starlite/ChEMBL References
Rattus norvegicus Serotonin 1a (5-HT1a) receptor Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni biogenic amine (5HT) receptor Get druggable targets OG5_133074 All targets in OG5_133074
Schistosoma japonicum Octopamine receptor, putative Get druggable targets OG5_133249 All targets in OG5_133249
Schistosoma japonicum ko:K04153 5-hydroxytryptamine (serotonin) receptor 1A, putative Get druggable targets OG5_133249 All targets in OG5_133249
Schistosoma mansoni biogenic amine (5HT) receptor Get druggable targets OG5_133249 All targets in OG5_133249
Echinococcus granulosus tm gpcr rhodopsin Get druggable targets OG5_145685 All targets in OG5_145685
Echinococcus multilocularis biogenic amine (5HT) receptor Get druggable targets OG5_133074 All targets in OG5_133074
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133249 All targets in OG5_133249
Echinococcus multilocularis serotonin receptor Get druggable targets OG5_133249 All targets in OG5_133249
Schistosoma japonicum expressed protein Get druggable targets OG5_133249 All targets in OG5_133249
Echinococcus granulosus biogenic amine 5HT receptor Get druggable targets OG5_133074 All targets in OG5_133074
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily Get druggable targets OG5_145685 All targets in OG5_145685
Echinococcus multilocularis serotonin receptor Get druggable targets OG5_133249 All targets in OG5_133249
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133249 All targets in OG5_133249
Echinococcus granulosus biogenic amine 5HT receptor Get druggable targets OG5_133249 All targets in OG5_133249
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Serotonin 1a (5-HT1a) receptor   422 aa 407 aa 23.3 %
Schistosoma japonicum ko:K04209 neuropeptide Y receptor, invertebrate, putative Serotonin 2a (5-HT2a) receptor   471 aa 405 aa 25.4 %
Schistosoma japonicum ko:K04207 neuropeptide Y receptor Y5, putative Serotonin 1a (5-HT1a) receptor   422 aa 339 aa 23.0 %
Echinococcus granulosus g protein coupled receptor Serotonin 1a (5-HT1a) receptor   422 aa 432 aa 23.4 %
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Serotonin 1a (5-HT1a) receptor   422 aa 417 aa 21.1 %
Onchocerca volvulus Serotonin 1a (5-HT1a) receptor   422 aa 426 aa 29.6 %
Echinococcus granulosus orexin receptor type 2 Serotonin 1a (5-HT1a) receptor   422 aa 369 aa 22.0 %
Echinococcus multilocularis g protein coupled receptor Serotonin 1a (5-HT1a) receptor   422 aa 433 aa 22.4 %
Schistosoma japonicum ko:K04136 adrenergic receptor, alpha 1b, putative Serotonin 1a (5-HT1a) receptor   422 aa 444 aa 29.3 %
Onchocerca volvulus Ubiquinol-cytochrome-c reductase complex assembly factor 1 homolog Serotonin 2a (5-HT2a) receptor   471 aa 435 aa 23.0 %
Loa Loa (eye worm) TYRA-2 protein Serotonin 1a (5-HT1a) receptor   422 aa 491 aa 27.3 %
Onchocerca volvulus Mitochondrial inner membrane protein homolog Serotonin 1a (5-HT1a) receptor   422 aa 383 aa 30.5 %
Schistosoma japonicum ko:K04145 dopamine receptor D2, putative Serotonin 1a (5-HT1a) receptor   422 aa 410 aa 27.8 %
Onchocerca volvulus Serotonin 1a (5-HT1a) receptor   422 aa 390 aa 33.6 %
Schistosoma japonicum Octopamine receptor 1, putative Serotonin 1a (5-HT1a) receptor   422 aa 424 aa 24.3 %
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor Serotonin 1a (5-HT1a) receptor   422 aa 350 aa 20.6 %
Loa Loa (eye worm) hypothetical protein Serotonin 1a (5-HT1a) receptor   422 aa 388 aa 26.5 %
Echinococcus multilocularis neuropeptides capa receptor Serotonin 1a (5-HT1a) receptor   422 aa 430 aa 20.0 %
Echinococcus granulosus alpha 1A adrenergic receptor Serotonin 1a (5-HT1a) receptor   422 aa 452 aa 21.0 %
Echinococcus multilocularis g protein coupled receptor Serotonin 1a (5-HT1a) receptor   422 aa 432 aa 23.6 %
Echinococcus granulosus g protein coupled receptor Serotonin 1a (5-HT1a) receptor   422 aa 432 aa 24.3 %
Onchocerca volvulus Glycoprotein hormone beta 5 homolog Serotonin 1a (5-HT1a) receptor   422 aa 477 aa 24.3 %
Onchocerca volvulus Serotonin 1a (5-HT1a) receptor   422 aa 436 aa 23.9 %
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Serotonin 1a (5-HT1a) receptor   422 aa 392 aa 20.7 %
Schistosoma mansoni amine GPCR Serotonin 1a (5-HT1a) receptor   422 aa 440 aa 31.6 %
Schistosoma japonicum ko:K04135 adrenergic receptor, alpha 1a, putative Serotonin 1a (5-HT1a) receptor   422 aa 448 aa 29.7 %
Echinococcus multilocularis orexin receptor type 2 Serotonin 1a (5-HT1a) receptor   422 aa 369 aa 22.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Acetyl/propionyl-CoA carboxylase (beta subunit) AccD6 0.0403 0.1253 0.3186
Echinococcus multilocularis dihydrolipoyllysine residue succinyltransferase 0.0104 0.0236 0.0197
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.1133 0.3736 1
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4_2 0.0403 0.1253 0.3186
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.287 0.9646 1
Echinococcus multilocularis neuropeptide s receptor 0.0482 0.1523 0.1489
Mycobacterium tuberculosis Probable branched-chain keto acid dehydrogenase E2 component BkdC 0.0104 0.0236 0.0395
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.0103 0.0078
Toxoplasma gondii carbamoylphosphate synthetase 0.0256 0.0753 0.0667
Echinococcus granulosus dihydrolipoyllysine residue succinyltransferase 0.0104 0.0236 0.0197
Toxoplasma gondii pyruvate carboxylase 0.1133 0.3736 0.3678
Leishmania major carboxylase, putative 0.1133 0.3736 0.3678
Echinococcus granulosus tm gpcr rhodopsin 0.1014 0.3331 0.3304
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.004 0.0042
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0104 0.0236 0.0297
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.1133 0.3736 0.3736
Mycobacterium ulcerans acetyl/propionyl CoA carboxylase subunit beta 0.0403 0.1253 0.3186
Leishmania major carbamoyl-phosphate synthase, putative 0.0256 0.0753 0.0667
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.0092 0.0052
Schistosoma mansoni biogenic amine (5HT) receptor 0.0161 0.043 0.043
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.1133 0.3736 0.3736
Loa Loa (eye worm) hypothetical protein 0.0104 0.0236 0.0245
Echinococcus multilocularis Biotin lipoyl attachment 0.0104 0.0236 0.0197
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0104 0.0236 0.0236
Echinococcus multilocularis neuropeptide receptor A26 0.0482 0.1523 0.1489
Schistosoma mansoni biogenic amine (5HT) receptor 0.0468 0.1476 0.1476
Trypanosoma cruzi dihydrolipoamide acetyltransferase, putative 0.0104 0.0236 0.0297
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.0103 0.0078
Schistosoma mansoni dihydrolipoamide succinyltransferase component of 2-oxoglutarate dehydrogenase 0.0104 0.0236 0.0236
Echinococcus granulosus biogenic amine 5HT receptor 0.0468 0.1476 0.1441
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.0092 0.0052
Leishmania major 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0104 0.0236 0.0145
Echinococcus multilocularis dihydrolipoyllysine residue acetyltransferase 0.0104 0.0236 0.0197
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0055 0.0057
Trypanosoma brucei acetyl-CoA carboxylase 0.2974 1 1
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.1133 0.3736 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0059 0.0084 0.0046
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.004 0.004
Trypanosoma brucei 2-oxoglutarate dehydrogenase E2 component, putative 0.0104 0.0236 0.0135
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4 0.0403 0.1253 0.3186
Leishmania major propionyl-coa carboxylase beta chain, putative 0.0403 0.1253 0.1172
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 5 AccD5 0.0403 0.1253 0.3186
Trypanosoma brucei dihydrolipoamide acetyltransferase E2 subunit, putative 0.0104 0.0236 0.0135
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.1133 0.3736 1
Leishmania major dihydrolipoamide acetyltransferase precursorlike protein 0.0104 0.0236 0.0145
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.1133 0.3736 0.3671
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0104 0.0236 0.0297
Trypanosoma brucei dihydrolipoamide branched chain transacylase, putative 0.0104 0.0236 0.0135
Loa Loa (eye worm) hypothetical protein 0.0161 0.043 0.0445
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0403 0.1253 0.1966
Trypanosoma brucei pyruvate dehydrogenase complex E3 binding protein, putative 0.0104 0.0236 0.0135
Leishmania major cathepsin L-like protease 0.0065 0.0103 0.0011
Echinococcus granulosus biogenic amine 5HT receptor 0.0161 0.043 0.0391
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0104 0.0236 0.0297
Echinococcus granulosus neuropeptide receptor A26 0.0482 0.1523 0.1489
Mycobacterium ulcerans acetyl-coenzyme a carboxylase carboxyl transferase (subunit beta) AccD3 0.0403 0.1253 0.3186
Mycobacterium leprae Probable propionyl-CoA carboxylase beta chain 5 AccD5 (PCCASE) (PROPANOYL-COA:CARBON DIOXIDE LIGASE) 0.0403 0.1253 0.2905
Mycobacterium ulcerans carbamoyl phosphate synthase large subunit 0.0256 0.0753 0.1813
Toxoplasma gondii acyl-CoA carboxyltransferase beta chain, putative 0.0403 0.1253 0.1172
Mycobacterium tuberculosis Probable propionyl-CoA carboxylase beta chain 5 AccD5 (pccase) (propanoyl-CoA:carbon dioxide ligase) 0.0403 0.1253 0.3186
Echinococcus granulosus propionyl coenzyme A carboxylase beta chain 0.0403 0.1253 0.1218
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.004 0.004
Giardia lamblia Acetyl-CoA carboxylase/pyruvate carboxylase fusion protein, putative 0.0507 0.1607 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.004 0.004
Trypanosoma cruzi acetyl-CoA carboxylase 0.1841 0.6146 1
Leishmania major cathepsin L-like protease 0.0065 0.0103 0.0011
Leishmania major dihydrolipoamide branched chain transacylase, putative 0.0104 0.0236 0.0145
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.1133 0.3736 1
Echinococcus granulosus Biotin lipoyl attachment 0.0104 0.0236 0.0197
Schistosoma mansoni aspartate carbamoyltransferase 0.0256 0.0753 0.0753
Chlamydia trachomatis biotin carboxylase 0.1029 0.3382 1
Plasmodium vivax carbamoyl phosphate synthetase, putative 0.0256 0.0753 0.0742
Entamoeba histolytica acetyl-coA carboxylase, putative 0.0507 0.1607 0.5
Brugia malayi Carboxyl transferase domain containing protein 0.287 0.9646 1
Trypanosoma cruzi glutamine-dependent carbamoyl-phosphate synthetase, putative 0.0256 0.0753 0.1145
Plasmodium falciparum carbamoyl phosphate synthetase 0.0256 0.0753 0.0742
Schistosoma mansoni acetyl-CoA carboxylase 0.2974 1 1
Brugia malayi Lipoamide acyltransferase component of branched-chain alpha-keto aciddehydrogenase complex, mitochondrial precursor 0.0104 0.0236 0.0245
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.1133 0.3736 0.6043
Trypanosoma cruzi cruzipain precursor, putative 0.0065 0.0103 0.0078
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0055 0.0057
Mycobacterium ulcerans branched-chain alpha-keto acid dehydrogenase subunit E2 0.0104 0.0236 0.0395
Echinococcus multilocularis serotonin receptor 0.0161 0.043 0.0391
Loa Loa (eye worm) hypothetical protein 0.0051 0.0055 0.0057
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.1133 0.3736 0.6043
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.2974 1 1
Trypanosoma brucei 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0403 0.1253 0.1162
Leishmania major dihydrolipoamide acetyltransferase precursor, putative 0.0104 0.0236 0.0145
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0104 0.0236 0.0297
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.1133 0.3736 0.3711
Mycobacterium ulcerans pyruvate carboxylase 0.1133 0.3736 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0468 0.1476 0.1441
Echinococcus granulosus dihydrolipoyllysine residue acetyltransferase 0.0104 0.0236 0.0197
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.1133 0.3736 0.3711
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.004 0.0042
Schistosoma mansoni propionyl-CoA carboxylase beta chain mitochondrial precursor 0.0403 0.1253 0.1253
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0104 0.0236 0.0297
Schistosoma mansoni pyruvate carboxylase 0.1133 0.3736 0.3736
Brugia malayi Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial precursor, puta 0.0104 0.0236 0.0245
Mycobacterium leprae Probable propyonyl-CoA carboxylase beta chain 4 AccD4 (Pccase) 0.0403 0.1253 0.2905
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0055 0.0057
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.0103 0.0078
Leishmania major 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0403 0.1253 0.1172
Mycobacterium ulcerans dihydrolipoamide acetyltransferase 0.0104 0.0236 0.0395
Echinococcus granulosus neuropeptide s receptor 0.0482 0.1523 0.1489
Loa Loa (eye worm) hypothetical protein 0.0104 0.0236 0.0245
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.1133 0.3736 1
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.2152 0.7204 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E2 0.0104 0.0236 0.0145
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.2974 1 1
Chlamydia trachomatis acetyl-coenzyme A carboxylase carboxyl transferase subunit beta 0.0403 0.1253 0.3233
Mycobacterium tuberculosis DlaT, dihydrolipoamide acyltransferase, E2 component of pyruvate dehydrogenase 0.0104 0.0236 0.0395
Brugia malayi dihydrolipoamide S-acetyltransferase precursor, putative 0.0104 0.0236 0.0245
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0092 0.0092
Leishmania major acetyl-CoA carboxylase, putative 0.2974 1 1
Mycobacterium ulcerans hypothetical protein 0.0104 0.0236 0.0395
Toxoplasma gondii 2-oxo acid dehydrogenases acyltransferase (catalytic domain) domain-containing protein 0.0104 0.0236 0.0145
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.1133 0.3736 1
Mycobacterium tuberculosis Biotinylated protein TB7.3 0.0104 0.0236 0.0395
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0092 0.0092
Trypanosoma brucei glutamine hydrolysing (not ammonia-dependent) carbomoyl phosphate synthase, putative 0.0256 0.0753 0.0657
Trypanosoma brucei unspecified product 0.0745 0.2416 0.2337
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0403 0.1253 0.1966
Echinococcus multilocularis propionyl coenzyme A carboxylase beta chain 0.0403 0.1253 0.1218
Treponema pallidum pyruvate carboxylase subunit B 0.0104 0.0236 0.5
Toxoplasma gondii dihydrolipoyllysine-residue succinyltransferase component of oxoglutarate dehydrogenase 0.0104 0.0236 0.0145
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.1133 0.3736 0.3678
Echinococcus multilocularis serotonin receptor 0.0161 0.043 0.0391
Mycobacterium ulcerans acetyl-/propionyl-CoA carboxylase subunit beta 0.0403 0.1253 0.3186
Schistosoma mansoni dihydrolipoamide S-acetyltransferase 0.0104 0.0236 0.0236
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.2974 1 1
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.1133 0.3736 1
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0256 0.0753 0.0753
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.2152 0.7204 1
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0104 0.0236 0.0297
Trypanosoma cruzi acetyl-CoA carboxylase, putative 0.0403 0.1253 0.1966
Mycobacterium leprae ACETYL/PROPIONYL-CoA CARBOXYLASE (BETA SUBUNIT) ACCD6 0.0403 0.1253 0.2905
Loa Loa (eye worm) hypothetical protein 0.0104 0.0236 0.0245
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0256 0.0753 0.0753
Toxoplasma gondii biotin-requiring enzyme domain-containing protein 0.0104 0.0236 0.0145
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1014 0.3331 0.3304
Loa Loa (eye worm) hypothetical protein 0.0161 0.043 0.0445
Toxoplasma gondii dihydrolipoamide acyltransferase, putative 0.0104 0.0236 0.0145
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0104 0.0236 0.0236
Trypanosoma cruzi glutamine dependent carbamoyl-phosphate synthase, putative 0.0256 0.0753 0.1145
Leishmania major cathepsin L-like protease 0.0065 0.0103 0.0011
Wolbachia endosymbiont of Brugia malayi Acetyl-CoA carboxylase, carboxyltransferase component 0.0403 0.1253 0.2905
Wolbachia endosymbiont of Brugia malayi carbamoyl phosphate synthase large subunit 0.0256 0.0753 0.1476
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.1133 0.3736 0.3671

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 44 nM Displacement of [3H]Ketanserin from rat cortex 5-HT2A receptor by liquid scintillation counter ChEMBL. 22277589
Ki (binding) = 335 nM Displacement of [3H]5-CT form human cloned 5HT7 receptor expressed in human HEK293 cells by liquid scintillation counter ChEMBL. 22277589
Ki (binding) = 1535 nM Displacement of [3H]-LSD from human full length cloned 5HT6 receptor expressed in human HEK293 cells by liquid scintillation counter ChEMBL. 22277589
Ki (binding) = 2030 nM Displacement of [3H]8-OH-DPAT from rat hippocampus 5-HT1A receptor by liquid scintillation counter ChEMBL. 22277589

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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