Detailed information for compound 1976896

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 395.861 | Formula: C17H18ClN3O4S
  • H donors: 2 H acceptors: 4 LogP: 2.47 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)/C(=N/NC(=O)c1cccc(c1)S(=O)(=O)N(C)C)/C)O
  • InChi: 1S/C17H18ClN3O4S/c1-11(15-10-13(18)7-8-16(15)22)19-20-17(23)12-5-4-6-14(9-12)26(24,25)21(2)3/h4-10,22H,1-3H3,(H,20,23)/b19-11+
  • InChiKey: ACKVOYWJCCXEPI-YBFXNURJSA-N  

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 lysine (K)-specific demethylase 1A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Onchocerca volvulus Get druggable targets OG5_130448 All targets in OG5_130448
Schistosoma mansoni Lysine-specific histone demethylase 1 Get druggable targets OG5_130448 All targets in OG5_130448
Echinococcus granulosus lysine specific histone demethylase 1A Get druggable targets OG5_130448 All targets in OG5_130448
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_130448 All targets in OG5_130448
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_130448 All targets in OG5_130448
Schistosoma japonicum ko:K00540 amine oxidase (flavin containing) domain 2 [EC:1.-.-.-], putative Get druggable targets OG5_130448 All targets in OG5_130448
Brugia malayi SWIRM domain containing protein Get druggable targets OG5_130448 All targets in OG5_130448
Echinococcus multilocularis lysine specific histone demethylase 1A Get druggable targets OG5_130448 All targets in OG5_130448
Schistosoma japonicum Lysine-specific histone demethylase 1, putative Get druggable targets OG5_130448 All targets in OG5_130448
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_130448 All targets in OG5_130448

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
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0017 0.0045 0.5
Loa Loa (eye worm) tubulin beta-2A chain 0.0035 0.2526 0.2526
Chlamydia trachomatis protoporphyrinogen oxidase 0.0017 0.0045 0.5
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0054 0.5066 0.5579
Echinococcus granulosus tubulin alpha 1C chain 0.0027 0.1495 0.1611
Trypanosoma cruzi epsilon tubulin, putative 0.0019 0.0393 0.1401
Echinococcus granulosus tubulin alpha 1C chain 0.0027 0.1495 0.1611
Mycobacterium tuberculosis Possible oxidoreductase 0.0017 0.0045 0.5
Giardia lamblia Beta tubulin 0.0035 0.2526 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0035 0.2526 1
Trypanosoma brucei beta tubulin 0.0035 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.1001 0.1001
Leishmania major beta tubulin 0.0035 0.2526 1
Plasmodium falciparum alpha tubulin 2 0.0027 0.1495 0.5844
Echinococcus granulosus tubulin beta 4A class IVa 0.0035 0.2526 0.2757
Loa Loa (eye worm) alpha-tubulin 0.0027 0.1495 0.1495
Leishmania major epsilon tubulin, putative 0.0019 0.0393 0.1401
Echinococcus multilocularis Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Loa Loa (eye worm) tubulin beta-4 chain 0.0035 0.2526 0.2526
Brugia malayi Tubulin alpha-2 chain 0.0027 0.1495 0.1456
Echinococcus multilocularis tubulin alpha 1C chain 0.0027 0.1495 0.1611
Entamoeba histolytica tubulin alpha chain, putative 0.0027 0.1495 0.5166
Onchocerca volvulus 0.009 1 0.5
Loa Loa (eye worm) tubulin alpha 2 0.0019 0.0348 0.0348
Trichomonas vaginalis tubulin epsilon chain, putative 0.0035 0.2526 1
Schistosoma mansoni tubulin subunit epsilon 0.0019 0.0393 0.0386
Echinococcus granulosus Tubulin beta 2C chain 0.0035 0.2526 0.2757
Trypanosoma brucei alpha tubulin 0.0027 0.1495 0.5166
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0027 0.1495 0.5918
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0045
Plasmodium vivax tubulin gamma chain, putative 0.0019 0.0393 0.1401
Leishmania major beta tubulin 0.0035 0.2526 1
Entamoeba histolytica tubulin family protein 0.0035 0.2526 1
Mycobacterium ulcerans oxidoreductase 0.0017 0.0045 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.0273 0.0273
Schistosoma mansoni hypothetical protein 0.0019 0.0273 0.0253
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Schistosoma mansoni hypothetical protein 0.0019 0.0273 0.0253
Loa Loa (eye worm) tubulin alpha 2 0.0019 0.0348 0.0348
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0017 0.0045 0.5
Loa Loa (eye worm) BEN-1 protein 0.0035 0.2526 0.2526
Echinococcus granulosus tubulin alpha chain 0.0027 0.1495 0.1611
Echinococcus granulosus tubulin epsilon chain 0.0019 0.0393 0.0386
Echinococcus multilocularis tubulin alpha 3 chain 0.0027 0.1495 0.1611
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0054 0.5066 0.5579
Schistosoma mansoni tubulin subunit alpha 0.0027 0.1495 0.1611
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.5066 0.5579
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0019 0.0348 0.0348
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0273 0.0253
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.5066 0.5579
Trichomonas vaginalis tubulin gamma chain, putative 0.0019 0.0393 0.1556
Trypanosoma brucei alpha tubulin 0.0027 0.1495 0.5166
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Echinococcus multilocularis tubulin beta 1 chain 0.0035 0.2526 0.2757
Echinococcus granulosus Tubulin beta 2C chain 0.0035 0.2526 0.2757
Echinococcus multilocularis tubulin alpha 0.0019 0.0393 0.0386
Toxoplasma gondii beta tubulin 0.0035 0.2526 1
Echinococcus granulosus tubulin alpha chain 0.0027 0.1495 0.1611
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0019 0.0348 0.1377
Toxoplasma gondii beta-1 tubulin, putative 0.0035 0.2526 1
Leishmania major beta tubulin 0.0035 0.2526 1
Leishmania major beta tubulin 0.0035 0.2526 1
Schistosoma mansoni alpha tubulin 0.0027 0.1495 0.1611
Plasmodium falciparum tubulin beta chain 0.0035 0.2526 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.5724 0.5724
Echinococcus multilocularis GPCR, family 2 0.0019 0.0273 0.0253
Echinococcus granulosus beta tubulin 0.0035 0.2526 0.2757
Echinococcus multilocularis tubulin alpha chain 0.0027 0.1495 0.1611
Echinococcus multilocularis Tubulin beta 2C chain 0.0035 0.2526 0.2757
Trichomonas vaginalis tubulin, putative 0.0035 0.2526 1
Mycobacterium ulcerans monoamine oxidase 0.0017 0.0045 0.5
Echinococcus multilocularis tubulin epsilon chain 0.0019 0.0393 0.0386
Leishmania major beta tubulin 0.0035 0.2526 1
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus granulosus tubulin alpha chain 0.0027 0.1495 0.1611
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus granulosus tubulin alpha 3 chain 0.0027 0.1495 0.1611
Trypanosoma brucei beta tubulin 0.0035 0.2526 1
Echinococcus multilocularis tubulin alpha chain 0.0027 0.1495 0.1611
Plasmodium falciparum tubulin epsilon chain, putative 0.0019 0.0393 0.1401
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0054 0.5066 0.5579
Loa Loa (eye worm) hypothetical protein 0.0083 0.9045 0.9045
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Trichomonas vaginalis tubulin alpha chain, putative 0.0019 0.0393 0.1556
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0273 0.0229
Leishmania major gamma-tubulin 0.0019 0.0393 0.1401
Echinococcus multilocularis tubulin subunit beta 0.0035 0.2526 0.2757
Echinococcus multilocularis tubulin gamma 1 chain 0.0019 0.0393 0.0386
Echinococcus granulosus Tubulin beta 2C chain 0.0035 0.2526 0.2757
Plasmodium falciparum tubulin gamma chain 0.0019 0.0393 0.1401
Loa Loa (eye worm) beta-tubulin 0.0035 0.2526 0.2526
Giardia lamblia Beta tubulin 0.0035 0.2526 1
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Echinococcus granulosus beta tubulin 0.0035 0.2526 0.2757
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus multilocularis beta tubulin 0.0035 0.2526 0.2757
Mycobacterium tuberculosis Conserved hypothetical protein 0.0017 0.0045 0.5
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Echinococcus multilocularis beta tubulin 0.0035 0.2526 0.2757
Mycobacterium ulcerans dehydrogenase 0.0017 0.0045 0.5
Schistosoma mansoni alpha tubulin 0.0027 0.1495 0.1611
Trypanosoma brucei alpha tubulin 0.0027 0.1495 0.5166
Loa Loa (eye worm) alpha-tubulin 0.0027 0.1495 0.1495
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0017 0.0045 0.5
Echinococcus granulosus tubulin gamma 1 chain 0.0019 0.0393 0.0386
Entamoeba histolytica tubulin family protein 0.0035 0.2526 1
Loa Loa (eye worm) tubulin alpha-2 chain 0.0027 0.1495 0.1495
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0083 0.9045 1
Plasmodium vivax tubulin alpha chain, putative 0.0027 0.1495 0.5844
Echinococcus multilocularis Tubulin beta 2C chain 0.0035 0.2526 0.2757
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0273 0.0253
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Toxoplasma gondii alpha tubulin TUBA1 0.0027 0.1495 0.5844
Plasmodium vivax tubulin epsilon chain, putative 0.0019 0.0393 0.1401
Echinococcus multilocularis tubulin alpha 3 chain 0.0027 0.1495 0.1611
Brugia malayi beta-tubulin, identical 0.0035 0.2526 0.2492
Schistosoma mansoni hypothetical protein 0.0019 0.0273 0.0253
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Loa Loa (eye worm) tubulin beta chain 0.0035 0.2526 0.2526
Loa Loa (eye worm) BEN-1 protein 0.0035 0.2526 0.2526
Loa Loa (eye worm) hypothetical protein 0.0027 0.1495 0.1495
Echinococcus multilocularis tubulin alpha chain 0.0027 0.1495 0.1611
Echinococcus multilocularis Tubulin beta 2C chain 0.0035 0.2526 0.2757
Schistosoma mansoni tubulin subunit gamma 0.0019 0.0393 0.0386
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0083 0.9045 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Trypanosoma cruzi beta tubulin, putative 0.0035 0.2526 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0019 0.0393 0.1401
Echinococcus granulosus tubulin alpha chain 0.0027 0.1495 0.1611
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Plasmodium falciparum alpha tubulin 1 0.0027 0.1495 0.5844
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.3201 0.317
Trypanosoma brucei beta tubulin 0.0035 0.2526 1
Echinococcus multilocularis tubulin subunit TubB 0.0027 0.1495 0.1611
Leishmania major beta tubulin 0.0035 0.2526 1
Schistosoma mansoni hypothetical protein 0.004 0.3201 0.3506
Echinococcus granulosus peroxisome assembly protein 26 0.0027 0.1495 0.1611
Schistosoma mansoni tubulin subunit alpha 0.0027 0.1495 0.1611
Loa Loa (eye worm) hypothetical protein 0.009 1 1
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0035 0.2526 0.2757
Brugia malayi Tubulin beta-1 chain 0.0035 0.2526 0.2492
Loa Loa (eye worm) tubulin alpha chain 0.0027 0.1495 0.1495
Leishmania major beta tubulin 0.0035 0.2526 1
Leishmania major beta tubulin 0.0035 0.2526 1
Loa Loa (eye worm) tubulin gamma chain 0.0019 0.0393 0.0393
Echinococcus multilocularis tubulin alpha chain 0.0027 0.1495 0.1611
Echinococcus multilocularis Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Giardia lamblia Alpha-tubulin 0.0027 0.1495 0.5166
Echinococcus granulosus tubulin subunit TubB 0.0027 0.1495 0.1611
Trichomonas vaginalis tubulin beta chain, putative 0.0035 0.2526 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0035 0.2526 0.2757
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0054 0.5066 0.5044
Loa Loa (eye worm) tubulin beta-1 chain 0.0035 0.2526 0.2526
Echinococcus multilocularis hypothetical protein 0.0027 0.1495 0.1611
Brugia malayi tubulin alpha-2 chain 0.0027 0.1495 0.1456
Trichomonas vaginalis tubulin gamma chain, putative 0.0019 0.0393 0.1556
Schistosoma mansoni alpha tubulin 0.0027 0.1495 0.1611
Echinococcus granulosus Tubulin beta 2C chain 0.0035 0.2526 0.2757
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.5724 0.5704
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0017 0.0045 0.5
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0273 0.0229
Leishmania major beta tubulin 0.0035 0.2526 1
Echinococcus granulosus alpha tubulin 0.0027 0.1495 0.1611
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Trypanosoma brucei alpha tubulin 0.0027 0.1495 0.5166
Toxoplasma gondii beta-tubulin, putative 0.0035 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0083 0.9045 0.9045
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0035 0.2526 0.2757
Schistosoma mansoni hypothetical protein 0.0019 0.0273 0.0253
Leishmania major beta tubulin 0.0035 0.2526 1
Trypanosoma cruzi tubulin gamma chain 0.0019 0.0393 0.1401
Toxoplasma gondii alpha-tubulin I, putative 0.0027 0.1495 0.5844
Echinococcus granulosus lysine specific histone demethylase 1A 0.0083 0.9045 1
Brugia malayi Tubulin alpha chain 0.0027 0.1495 0.1456
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0054 0.5066 0.5066
Loa Loa (eye worm) hypothetical protein 0.004 0.3201 0.3201
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Echinococcus multilocularis peroxisome assembly protein 26 0.0027 0.1495 0.1611
Brugia malayi Tubulin alpha-2 chain 0.0027 0.1495 0.1456
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Trichomonas vaginalis tubulin epsilon chain, putative 0.0035 0.2526 1
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Echinococcus multilocularis tubulin alpha 1C chain 0.0027 0.1495 0.1611
Echinococcus granulosus tubulin alpha chain 0.0027 0.1495 0.1611
Trypanosoma cruzi epsilon tubulin, putative 0.0019 0.0393 0.1401
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Loa Loa (eye worm) tubulin alpha chain 0.0027 0.1495 0.1495
Trichomonas vaginalis tubulin epsilon chain, putative 0.0027 0.1495 0.5918
Schistosoma mansoni tubulin subunit beta 0.0035 0.2526 0.2757
Trichomonas vaginalis tubulin beta chain, putative 0.0027 0.1495 0.5918
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.5724 0.5704
Echinococcus granulosus tubulin beta 1 chain 0.0035 0.2526 0.2757
Echinococcus granulosus tubulin subunit beta 0.0035 0.2526 0.2757
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0273 0.0273
Plasmodium vivax tubulin alpha chain, putative 0.0027 0.1495 0.5844
Echinococcus granulosus Tubulin beta 2C chain 0.0035 0.2526 0.2757
Plasmodium vivax tubulin beta chain, putative 0.0035 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0348 0.0348
Brugia malayi alpha-tubulin 0.0027 0.1495 0.1456
Brugia malayi Tubulin gamma chain 0.0019 0.0393 0.0349
Entamoeba histolytica tubulin alpha-1 chain 0.0027 0.1495 0.5166
Echinococcus granulosus tubulin alpha 0.0019 0.0393 0.0386
Leishmania major beta tubulin 0.0035 0.2526 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0027 0.1495 0.5918
Trypanosoma cruzi alpha tubulin, putative 0.0027 0.1495 0.5844
Echinococcus granulosus Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0273 0.0253
Echinococcus multilocularis Tubulin alpha 1 chain 0.0027 0.1495 0.1611
Echinococcus granulosus tubulin alpha 3 chain 0.0027 0.1495 0.1611
Giardia lamblia Alpha-tubulin 0.0027 0.1495 0.5166
Brugia malayi tubulin alpha chain - mouse 0.0027 0.1495 0.1456
Giardia lamblia Beta tubulin 0.0035 0.2526 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.5066 0.5579
Trypanosoma brucei beta tubulin 0.0035 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0058 0.5724 0.5724
Leishmania major beta tubulin 0.0035 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0045
Leishmania major beta tubulin 0.0035 0.2526 1
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0054 0.5066 0.5579
Schistosoma mansoni tubulin subunit alpha 0.0027 0.1495 0.1611
Trichomonas vaginalis tubulin alpha chain, putative 0.0035 0.2526 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0273 0.0253
Echinococcus multilocularis tubulin alpha chain 0.0027 0.1495 0.1611
Leishmania major alpha tubulin 0.0027 0.1495 0.5844
Echinococcus granulosus GPCR family 2 0.0019 0.0273 0.0253
Brugia malayi amine oxidase, flavin-containing family protein 0.0024 0.1001 0.096
Leishmania major alpha tubulin 0.0027 0.1495 0.5844

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 13 nM BindingDB_Patents: Inhibitor Screening Assay. The primary assay for compound inhibitory activity was the LSD1 Inhibitor Screening Assay Kit (Cayman Chemical Company, Ann Arbor, Mich.; Cayman Chemical Item Number 700120). Briefly, test compounds were diluted to 20.times. the desired test concentration in 100% DMSO and 2.5 .mu.L of the diluted drug sample was added to a black 384-well plate. The LSD1 enzyme stock was diluted 17-fold with assay buffer and 40 .mu.M of the diluted LSD1 enzyme was added to the appropriate wells. The reaction mixture comprised horseradish peroxidase, dimethyl K4 peptide (corresponding to the first 21 amino acids of the N-terminal tail of histone H3), and 10-acetyl-3,7-dihydroxyphenoxazine was then added to wells. Generation of resorufin (generated by reacting with H.sub.2O.sub.2 produced in the reaction) was analyzed on an Envision microplate reader with an excitation wavelength of 530 nm and an emission wavelength of 595 nm. ChEMBL. No reference
IC50 (binding) > 300000 nM BindingDB_Patents: MAO-GloTM Assay. Inhibition of monoamine oxidase activity was carried used using the MAO-Glo.TM. Assay Kit according to the manufacturer's suggested protocol. Briefly, 6.25 .mu.L of test compound was added to each well of a 384-well plate. Enzyme (either MAO A or B) was added (12.5 .mu.L in 2.times. buffer containing 1 .mu.g protein) and allowed to incubate for 5 minutes. Finally, 6.25 .mu.L of 4.times.MAO substrate was added to each well. Following a one hour incubation, 25 .mu.L of Luciferin detection reagent was added to each well, and incubated for 20 minutes. Luminescence was then measured on an Envision microplate reader. ChEMBL. No reference
IC50 (binding) > 300000 nM MAO-GloTM Assay BINDINGDB. No reference

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

No literature references available for this target.

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