TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 642.766 | Formula: C31H42N6O7S
H donors: 6 H acceptors: 6 LogP: 1.04 Rotable bonds: 22
Rule of 5 violations (Lipinski): 3
SMILES: SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)OCc1ccccc1)C)Cc1ccccc1)C(C)C)CC(=O)N)N
InChi: 1S/C31H42N6O7S/c1-18(2)26(37-29(41)24(15-25(33)38)35-27(39)22(32)17-45)30(42)36-23(14-20-10-6-4-7-11-20)28(40)34-19(3)31(43)44-16-21-12-8-5-9-13-21/h4-13,18-19,22-24,26,45H,14-17,32H2,1-3H3,(H2,33,38)(H,34,40)(H,35,39)(H,36,42)(H,37,41)/t19-,22-,23-,24-,26-/m0/s1
InChiKey: TYHNWJHQRDLUOY-VNJQJXRGSA-N

Network

Hover on a compound node to display the structore

Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Gallus gallus	Myosin light chain kinase, smooth muscle	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	serine:threonine protein kinase	Get druggable targets OG5_133428	All targets in OG5_133428
Echinococcus granulosus	serine:threonine protein kinase	Get druggable targets OG5_133428	All targets in OG5_133428
Echinococcus multilocularis	myosin light chain kinase, smooth muscle	Get druggable targets OG5_133428	All targets in OG5_133428
Echinococcus granulosus	myosin light chain kinase smooth muscle	Get druggable targets OG5_133428	All targets in OG5_133428

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0075	0.135	0.135
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0111	0.2064	0.2064
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0239	0.4609	0.5946
Echinococcus granulosus	cathepsin L cysteine protease	0.0187	0.3572	0.3572
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Brugia malayi	Papain family cysteine protease containing protein	0.0075	0.135	0.135
Trypanosoma cruzi	cysteine proteinase, putative	0.0187	0.3572	0.2569
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.035	0.6832	0.6832
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Echinococcus granulosus	cathepsin L cysteine proteinase	0.035	0.6832	0.6832
Toxoplasma gondii	cathepsin CPL	0.035	0.6832	1
Plasmodium vivax	vivapain-1	0.0187	0.3572	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0187	0.3572	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0239	0.4609	0.5946
Brugia malayi	cathepsin L-like cysteine proteinase	0.0075	0.135	0.135
Plasmodium vivax	unspecified product	0.0111	0.2064	0.1303
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0508	1	1
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Loa Loa (eye worm)	hypothetical protein	0.0508	1	1
Entamoeba histolytica	cysteine protease, putative	0.035	0.6832	1
Echinococcus multilocularis	cysteine protease	0.035	0.6832	0.6832
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Entamoeba histolytica	cysteine proteinase, putative	0.0187	0.3572	0.4054
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0187	0.3572	0.3572
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0111	0.2064	0.0826
Brugia malayi	Papain family cysteine protease containing protein	0.0187	0.3572	0.3572
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Loa Loa (eye worm)	hypothetical protein	0.0239	0.4609	0.4609
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Onchocerca volvulus		0.035	0.6832	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.035	0.6832	0.6832
Brugia malayi	Papain family cysteine protease containing protein	0.0187	0.3572	0.3572
Onchocerca volvulus		0.035	0.6832	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0187	0.3572	0.2569
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Onchocerca volvulus	Cathepsin L homolog	0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0075	0.135	0.135
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0008	0.0006	0.0006
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Schistosoma mansoni	cathepsin B (C01 family)	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Echinococcus granulosus	cathepsin b	0.0508	1	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Plasmodium falciparum	cysteine proteinase falcipain 3	0.035	0.6832	1
Onchocerca volvulus	Cathepsin L homolog	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Toxoplasma gondii	cathepsin B	0.0209	0.4025	0.488
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Giardia lamblia	Cathepsin B precursor	0.0209	0.4025	1
Plasmodium vivax	vivapain-2	0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0508	1	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0075	0.135	0.135
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.035	0.6832	0.6832
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	fibroinase	0.035	0.6832	0.6832
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Echinococcus granulosus	cathepsin l1	0.0239	0.4609	0.4609
Trypanosoma cruzi	cysteine peptidase, putative	0.035	0.6832	0.6337
Loa Loa (eye worm)	hypothetical protein	0.0239	0.4609	0.4609
Brugia malayi	cathepsin L-like precursor	0.0239	0.4609	0.4609
Echinococcus granulosus	cathepsin L	0.0187	0.3572	0.3572
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Brugia malayi	Papain family cysteine protease containing protein	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Loa Loa (eye worm)	ctsf protein	0.035	0.6832	0.6832
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0075	0.135	0.135
Echinococcus multilocularis	cysteine protease	0.035	0.6832	0.6832
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0075	0.135	0.135
Onchocerca volvulus		0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0075	0.135	0.135
Echinococcus granulosus	cysteine protease	0.0187	0.3572	0.3572
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.035	0.6832	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	cathepsin B	0.0209	0.4025	0.4025
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0111	0.2064	0.2064
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Echinococcus granulosus	serine:threonine protein kinase	0.0294	0.5715	0.5715
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0075	0.135	0.135
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Echinococcus granulosus	myosin light chain kinase smooth muscle	0.0294	0.5715	0.5715
Echinococcus multilocularis	cathepsin b	0.0508	1	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0111	0.2064	0.2064
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Loa Loa (eye worm)	hypothetical protein	0.0111	0.2064	0.2064
Brugia malayi	fibroinase precursor	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0075	0.135	0.135
Trypanosoma cruzi	cruzipain precursor, putative	0.035	0.6832	0.6337
Entamoeba histolytica	cysteine proteinase, putative	0.0187	0.3572	0.4054
Echinococcus granulosus	cathepsin l cysteine peptidase	0.035	0.6832	0.6832
Schistosoma mansoni	cathepsin F (C01 family)	0.035	0.6832	0.6832
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0508	1	1
Onchocerca volvulus	Cathepsin F homolog	0.035	0.6832	1
Loa Loa (eye worm)	hypothetical protein	0.035	0.6832	0.6832
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0008	0.0006	0.0006
Schistosoma mansoni	cathepsin s	0.0111	0.2064	0.2064
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0508	1	1
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0008	0.0006	0.0006
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0187	0.3572	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0075	0.135	0.135
Entamoeba histolytica	cysteine proteinase 2	0.0187	0.3572	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0209	0.4025	0.4025
Schistosoma mansoni	cathepsin C	0.0075	0.135	0.135
Onchocerca volvulus		0.035	0.6832	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0239	0.4609	0.4609
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0075	0.135	0.135
Echinococcus granulosus	cathepsin l1	0.035	0.6832	0.6832
Trypanosoma cruzi	cysteine peptidase, putative	0.0187	0.3572	0.2569
Echinococcus multilocularis	cathepsin L cysteine protease	0.035	0.6832	0.6832
Brugia malayi	cathepsin F-like cysteine proteinase	0.0111	0.2064	0.2064
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0075	0.135	0.135
Brugia malayi	Cathepsin L-like precursor	0.0239	0.4609	0.4609
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0209	0.4025	0.3093
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Onchocerca volvulus		0.035	0.6832	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Echinococcus granulosus	titin	0.0008	0.0006	0.0006
Trypanosoma cruzi	cysteine proteinase, putative	0.0187	0.3572	0.2569
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Onchocerca volvulus		0.0239	0.4609	0.6747
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Trypanosoma cruzi	cysteine peptidase, putative	0.035	0.6832	0.6337
Schistosoma mansoni	cathepsin F (C01 family)	0.0239	0.4609	0.4609
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.035	0.6832	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Schistosoma mansoni	cathepsin S (C01 family)	0.0075	0.135	0.135
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0075	0.135	0.135
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Trypanosoma cruzi	cysteine protease, putative	0.0187	0.3572	0.2569
Trypanosoma cruzi	cysteine peptidase, putative	0.035	0.6832	0.6337
Loa Loa (eye worm)	cysteine protease	0.035	0.6832	0.6832
Entamoeba histolytica	cysteine proteinase, putative	0.035	0.6832	1
Echinococcus multilocularis	myosin light chain kinase, smooth muscle	0.0294	0.5715	0.5715
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0187	0.3572	0.3572
Plasmodium vivax	vivapain-3	0.0187	0.3572	0.4054
Leishmania major	cysteine peptidase A (CPA)	0.035	0.6832	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0075	0.135	0.135
Loa Loa (eye worm)	hypothetical protein	0.0111	0.2064	0.2064
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Onchocerca volvulus		0.0008	0.0006	0.0008
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0209	0.4025	0.488
Leishmania major	cathepsin L-like protease	0.035	0.6832	1
Entamoeba histolytica	cysteine proteinase, putative	0.035	0.6832	1
Loa Loa (eye worm)	hypothetical protein	0.0075	0.135	0.135
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Entamoeba histolytica	cysteine proteinase, putative	0.0187	0.3572	0.4054
Echinococcus multilocularis	cathepsin L	0.0075	0.135	0.135
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0187	0.3572	0.3572
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0075	0.135	0.135
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0209	0.4025	0.139
Entamoeba histolytica	cysteine proteinase, putative	0.0187	0.3572	0.4054
Echinococcus multilocularis	cathepsin b	0.0508	1	1
Echinococcus granulosus	cathepsin b	0.0508	1	1
Brugia malayi	Cathepsin L-like precursor	0.035	0.6832	0.6832
Plasmodium vivax	vivapain-2	0.035	0.6832	1
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0006	0.0006
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Brugia malayi	Papain family cysteine protease containing protein	0.0075	0.135	0.135
Onchocerca volvulus		0.0075	0.135	0.1976
Echinococcus granulosus	cathepsin L	0.0075	0.135	0.135
Brugia malayi	Cathepsin L-like precursor	0.0111	0.2064	0.2064
Echinococcus multilocularis	titin	0.0008	0.0006	0.0006
Entamoeba histolytica	cysteine proteinase 1, putative	0.0187	0.3572	0.4054
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0075	0.135	0.135
Brugia malayi	cathepsin F-like cysteine proteinase	0.0075	0.135	0.135
Brugia malayi	cathepsin L precursor	0.0075	0.135	0.135
Schistosoma mansoni	titin	0.0008	0.0006	0.0006
Trypanosoma cruzi	cysteine peptidase, putative	0.035	0.6832	0.6337
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Echinococcus multilocularis	cathepsin L	0.0187	0.3572	0.3572
Giardia lamblia	Cathepsin B precursor	0.0209	0.4025	1
Onchocerca volvulus		0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0187	0.3572	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.035	0.6832	0.6832
Onchocerca volvulus	Cathepsin L homolog	0.0075	0.135	0.1976
Giardia lamblia	Cathepsin B precursor	0.0209	0.4025	1
Echinococcus multilocularis	serine:threonine protein kinase	0.0294	0.5715	0.5715
Loa Loa (eye worm)	hypothetical protein	0.0239	0.4609	0.4609
Brugia malayi	protein unc-22	0.0008	0.0006	0.0006
Trypanosoma cruzi	cruzipain precursor, putative	0.0111	0.2064	0.0826
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Echinococcus granulosus	titin	0.0008	0.0006	0.0006
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.035	0.6832	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.6832	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0508	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.035	0.6832	0.6832
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.035	0.6832	0.6832
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0239	0.4609	0.3768
Brugia malayi	Cathepsin L-like precursor	0.0239	0.4609	0.4609
Entamoeba histolytica	cysteine proteinase, putative	0.0239	0.4609	0.5946
Entamoeba histolytica	cysteine protease, putative	0.0187	0.3572	0.4054
Echinococcus multilocularis	cathepsin L cysteine protease	0.035	0.6832	0.6832
Plasmodium vivax	unspecified product	0.0187	0.3572	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.035	0.6832	1
Loa Loa (eye worm)	CAMK protein kinase	0.0008	0.0006	0.0006
Onchocerca volvulus		0.035	0.6832	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 8 uM	Inhibition of native form of chicken MLCK (myosin light chain kinase)	ChEMBL.	2308147
IC50 (binding)	= 8 uM	Inhibition of native form of chicken MLCK (myosin light chain kinase)	ChEMBL.	2308147

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

No external resources registered 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.

Detailed information for compound 309460