Detailed information for compound 1075619

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 498.659 | Formula: C31H38N4O2
  • H donors: 1 H acceptors: 2 LogP: 5.06 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(C(=O)c1ccc(cc1)N(c1cccc(c1)NC(=O)C)C1CCN(CC1)Cc1ccccc1)CC
  • InChi: 1S/C31H38N4O2/c1-4-34(5-2)31(37)26-14-16-28(17-15-26)35(30-13-9-12-27(22-30)32-24(3)36)29-18-20-33(21-19-29)23-25-10-7-6-8-11-25/h6-17,22,29H,4-5,18-21,23H2,1-3H3,(H,32,36)
  • InChiKey: XTJAWYNXRXRTMU-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 opioid receptor, mu 1 Starlite/ChEMBL References
Homo sapiens opioid receptor, delta 1 Starlite/ChEMBL References
Homo sapiens opioid receptor, kappa 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus tm gpcr rhodopsin Get druggable targets OG5_139759 All targets in OG5_139759
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily Get druggable targets OG5_139759 All targets in OG5_139759
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0051 0.0502 0.0493
Echinococcus granulosus caspase 8 0.0107 0.1343 0.1005
Schistosoma mansoni jumonji/arid domain-containing protein 0.0066 0.0728 0.0366
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0043 0.0376 0.1873
Schistosoma mansoni serine/threonine protein kinase 0.0212 0.2935 0.266
Loa Loa (eye worm) hypothetical protein 0.0185 0.2532 0.2416
Schistosoma mansoni kinase 0.0108 0.1355 0.1017
Trypanosoma brucei metacaspase 0.0107 0.1343 0.4276
Schistosoma mansoni caspase-3 (C14 family) 0.0347 0.4986 0.4791
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.013 0.1698 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0063 0.0684 0.1909
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0087 0.1043 0.0693
Trypanosoma cruzi polo-like protein kinase, putative 0.0212 0.2935 1
Trichomonas vaginalis Sentrin-specific protease, putative 0.0104 0.1292 0.3579
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0107 0.1343 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0495 0.0123
Trypanosoma cruzi metacaspase 5, putative 0.0107 0.1343 0.4276
Echinococcus multilocularis caspase 8 0.0107 0.1343 0.1005
Trypanosoma brucei trypanothione reductase 0.0051 0.0501 0.1251
Echinococcus granulosus importin subunit beta 1 0.0063 0.0684 0.032
Echinococcus granulosus GTP binding nuclear protein Ran 0.0047 0.043 0.0056
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0495 0.0347
Echinococcus granulosus caspase 2 0.0152 0.2022 0.1711
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0062 0.0667 0.1388
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0087 0.1043 0.5694
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.013 0.1698 1
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.1312 0.3659
Brugia malayi Importin beta-1 subunit 0.0063 0.0684 0.2331
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 0.7481
Echinococcus multilocularis importin subunit beta 1 0.0063 0.0684 0.032
Plasmodium falciparum glutathione reductase 0.0051 0.0501 0.2925
Schistosoma mansoni caspase-7 (C14 family) 0.0152 0.2022 0.1711
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0066 0.0728 0.0366
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0117 0.15 0.8342
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0047 0.043 0.0996
Plasmodium vivax sentrin-specific protease 1, putative 0.0043 0.0376 0.1873
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0043 0.0376 0.1281
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0043 0.0376 0.1873
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0104 0.1292 0.3579
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase 0.0347 0.4986 0.4791
Loa Loa (eye worm) Ulp1 protease 0.0043 0.0376 0.0226
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.003 0.0177 0.02
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0062 0.0667 0.0303
Loa Loa (eye worm) hypothetical protein 0.0043 0.0376 0.0226
Plasmodium falciparum metacaspase 1 0.0107 0.1343 1
Brugia malayi glutathione reductase 0.0051 0.0501 0.1707
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0058 0.0604 0.0458
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0117 0.15 0.8696
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0062 0.0667 0.0303
Echinococcus multilocularis apoptotic protease activating factor 1 0.0045 0.0401 0.0026
Plasmodium vivax sentrin-specific protease 2, putative 0.0043 0.0376 0.1873
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Plasmodium falciparum importin beta, putative 0.0063 0.0684 0.4464
Toxoplasma gondii hypothetical protein 0.003 0.0177 0.02
Trypanosoma brucei metacaspase 5, putative 0.0107 0.1343 0.4276
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.013 0.1698 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0117 0.15 0.8342
Brugia malayi jmjC domain containing protein 0.0066 0.0728 0.2482
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Schistosoma mansoni jumonji domain containing protein 0.0066 0.0728 0.0366
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 1
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Toxoplasma gondii thioredoxin reductase 0.0051 0.0501 0.2925
Trypanosoma brucei metacaspase MCA3 0.0107 0.1343 0.4276
Trypanosoma brucei metacaspase MCA2 0.0107 0.1343 0.4276
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0047 0.043 0.2328
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0104 0.1292 0.3579
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Plasmodium vivax hypothetical protein, conserved 0.0107 0.1343 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0495 0.0123
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0104 0.1292 0.4402
Loa Loa (eye worm) hypothetical protein 0.0152 0.2022 0.1898
Onchocerca volvulus Serine\/threonine kinase homolog 0.0212 0.2935 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0057 0.0588 0.2701
Schistosoma mansoni ran 0.0047 0.043 0.0056
Loa Loa (eye worm) Ulp1 protease 0.0104 0.1292 0.1157
Loa Loa (eye worm) hypothetical protein 0.0063 0.0684 0.0539
Loa Loa (eye worm) glutathione reductase 0.0051 0.0501 0.0353
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0107 0.1343 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0057 0.0588 0.0724
Mycobacterium tuberculosis Probable reductase 0.0117 0.15 0.8342
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0117 0.15 0.8342
Schistosoma mansoni hypothetical protein 0.0045 0.0401 0.0026
Schistosoma mansoni subfamily C14A unassigned peptidase (C14 family) 0.0107 0.1343 0.1005
Entamoeba histolytica hypothetical protein 0.0051 0.0502 0.0493
Loa Loa (eye worm) hypothetical protein 0.0107 0.1343 0.1208
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0495 0.0123
Echinococcus multilocularis caspase 0.0347 0.4986 0.4791
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0495 0.0123
Entamoeba histolytica Ran family GTPase 0.0047 0.043 0.0211
Brugia malayi Thioredoxin reductase 0.0051 0.0501 0.1707
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0047 0.043 0.1465
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0047 0.043 0.0056
Schistosoma mansoni caspase-7 (C14 family) 0.0347 0.4986 0.4791
Trypanosoma cruzi metacaspase, putative 0.0107 0.1343 0.4276
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0047 0.043 0.0996
Onchocerca volvulus Cell death protein 3 homolog 0.0152 0.2022 0.6432
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0212 0.2935 0.266
Echinococcus granulosus lysine specific demethylase 5A 0.0066 0.0728 0.0366
Leishmania major metacaspase, putative 0.0107 0.1343 0.4276
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0495 0.0123
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0185 0.2532 0.8422
Echinococcus granulosus tm gpcr rhodopsin 0.0634 0.9334 0.9308
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.1312 0.3659
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0087 0.1043 0.7481
Schistosoma mansoni ran 0.0047 0.043 0.0056
Brugia malayi mucosa associated lymphoid tissue lymphoma translocation protein 1 0.0107 0.1343 0.4575
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0062 0.0667 0.1848
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0212 0.2935 0.2826
Trypanosoma cruzi importin beta-1 subunit, putative 0.0051 0.0502 0.1255
Plasmodium vivax importin-beta 2, putative 0.0063 0.0684 0.4464
Trypanosoma cruzi SUMO1/Ulp2, putative 0.0043 0.0376 0.0801
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0212 0.2935 0.266
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0104 0.1292 0.3579
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0062 0.0667 0.0303
Trypanosoma brucei SUMO1/Ulp2, putative 0.0043 0.0376 0.0801
Echinococcus multilocularis sentrin specific protease 8 0.0104 0.1292 0.0952
Leishmania major importin beta-1 subunit, putative 0.0051 0.0502 0.1255
Echinococcus granulosus thioredoxin glutathione reductase 0.0051 0.0501 0.013
Echinococcus multilocularis peptidase Clp (S14 family) 0.0057 0.0588 0.022
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0107 0.1343 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0495 0.0123
Loa Loa (eye worm) hypothetical protein 0.0043 0.0376 0.0226
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0043 0.0376 0.1873
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0043 0.0376 0.1281
Plasmodium falciparum sentrin-specific protease 1 0.0043 0.0376 0.1873
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0057 0.0588 0.0724
Mycobacterium tuberculosis Probable oxidoreductase 0.013 0.1698 1
Leishmania major GTP-binding protein, putative 0.0047 0.043 0.0996
Loa Loa (eye worm) hypothetical protein 0.0045 0.0401 0.0252
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 1
Brugia malayi hypothetical protein 0.0045 0.0401 0.1365
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Brugia malayi serine/threonine-protein kinase plk-2 0.0212 0.2935 1
Giardia lamblia Kinase, PLK 0.0212 0.2935 1
Plasmodium falciparum metacaspase-like protein 0.0107 0.1343 1
Echinococcus multilocularis caspase 2 0.0152 0.2022 0.1711
Trypanosoma cruzi polo-like protein kinase, putative 0.0212 0.2935 1
Echinococcus multilocularis caspase 3 0.024 0.3365 0.3106
Schistosoma mansoni jumonji/arid domain-containing protein 0.0066 0.0728 0.0366
Trichomonas vaginalis ran, putative 0.0047 0.043 0.0211
Trypanosoma cruzi trypanothione reductase, putative 0.0051 0.0501 0.1251
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Brugia malayi jmjC domain containing protein 0.0066 0.0728 0.2482
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0047 0.043 0.2328
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0043 0.0376 0.1281
Plasmodium vivax metacaspase 1, putative 0.0107 0.1343 1
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0062 0.0667 0.2273
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0087 0.1043 0.7481
Trichomonas vaginalis CAMK family protein kinase 0.0212 0.2935 1
Trypanosoma cruzi hypothetical protein 0.0104 0.1292 0.4094
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0634 0.9334 0.9308
Plasmodium vivax thioredoxin reductase, putative 0.0051 0.0501 0.2925
Echinococcus multilocularis lysine specific demethylase 5A 0.0066 0.0728 0.0366
Toxoplasma gondii HEAT repeat-containing protein 0.0063 0.0684 0.4464
Echinococcus granulosus caspase 0.0347 0.4986 0.4791
Loa Loa (eye worm) hypothetical protein 0.0087 0.1043 0.0904
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Onchocerca volvulus 0.0045 0.0401 0.0097
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0104 0.1292 0.3579
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0047 0.043 0.0996
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0495 0.1685
Trypanosoma brucei importin beta-1 subunit, putative 0.0063 0.0684 0.1909
Trypanosoma cruzi metacaspase, putative 0.0107 0.1343 0.4276
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0495 0.0123
Brugia malayi Cell death protein 3 precursor 0.0152 0.2022 0.6889
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Trichomonas vaginalis importin beta-1, putative 0.0051 0.0502 0.0493
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0185 0.2532 0.8422
Echinococcus multilocularis thioredoxin glutathione reductase 0.0051 0.0501 0.013
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0104 0.1292 0.0952
Echinococcus granulosus apoptotic protease activating factor 1 0.0045 0.0401 0.0026
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase 0.0347 0.4986 0.4791
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0051 0.0502 0.0493
Loa Loa (eye worm) hypothetical protein 0.0043 0.0376 0.0226
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0087 0.1043 0.0693
Plasmodium falciparum thioredoxin reductase 0.0051 0.0501 0.2925
Trypanosoma brucei polo-like protein kinase 0.0212 0.2935 1
Trypanosoma brucei Metacaspase-4 0.0107 0.1343 0.4276
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0117 0.15 0.8342
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0066 0.0728 0.0366
Brugia malayi hypothetical protein 0.0028 0.0153 0.0521
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0087 0.1043 1
Echinococcus granulosus sentrin specific protease 8 0.0104 0.1292 0.0952
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Brugia malayi Probable ClpP-like protease 0.0087 0.1043 0.3554
Brugia malayi RNA, U transporter 1 0.018 0.2459 0.8378
Loa Loa (eye worm) jmjC domain-containing protein 0.0066 0.0728 0.0584
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0047 0.043 0.2328
Plasmodium vivax glutathione reductase, putative 0.0051 0.0501 0.2925
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1343 0.3778
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0117 0.15 0.8342
Leishmania major SUMO1/Ulp2, putative,cysteine peptidase, Clan CA, family C48, putative 0.0043 0.0376 0.0801
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.003 0.0177 0.02
Echinococcus granulosus caspase 3 0.024 0.3365 0.3106
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0212 0.2935 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0047 0.043 0.0281
Trypanosoma cruzi cysteine peptidase, Clan CA, family C48, putative 0.0043 0.0376 0.0801
Echinococcus granulosus peptidase Clp S14 family 0.0057 0.0588 0.022
Schistosoma mansoni importin beta-1 0.0063 0.0684 0.032
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0107 0.1343 0.3778
Trypanosoma cruzi metacaspase, putative 0.0107 0.1343 0.4276
Entamoeba histolytica serine/threonine protein kinase, putative 0.0212 0.2935 1
Loa Loa (eye worm) thioredoxin reductase 0.0051 0.0501 0.0353
Leishmania major trypanothione reductase 0.0051 0.0501 0.1251
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0047 0.043 0.0211
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0087 0.1043 0.7481
Trypanosoma cruzi metacaspase 5, putative 0.0107 0.1343 0.4276
Schistosoma mansoni peptidase Clp (S14 family) 0.0087 0.1043 0.0693
Trypanosoma cruzi metacaspase, putative 0.0107 0.1343 0.4276

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) = 6.94 nM Agonist activity at human delta opioid receptor by GTP[gamma]35S binding assay ChEMBL. 19800790
Emax (binding) = 96 % Agonist activity at human delta opioid receptor by GTP[gamma]35S binding assay relative to SNC80 ChEMBL. 19800790
Ki (binding) = 1.79 nM Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptor ChEMBL. 19800790
Ki (binding) = 1017 nM Displacement of [125I]FK33824 from human cloned mu opioid receptor ChEMBL. 19800790
Ki (binding) > 10000 nM Displacement of [125I]D-pro10-dynorphin from human cloned kappa opioid receptor ChEMBL. 19800790

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.