Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T56418 | Target Info | |||
| Target Name | ALK tyrosine kinase receptor (ALK) | ||||
| Synonyms |
CD246; Anaplastic lymphoma kinase
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| Target Type | Successful Target | ||||
| Gene Name | ALK | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 16 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
(Z)-3-((1H-pyrrol-2-yl)methylene)indolin-2-one
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Investigative | Compound Info | ||
| Synonyms |
oxindole i; CHEMBL86755; 3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydroindol-2-one; oxindole 1; AC1NZGXV; K00027; (Z)-3-((1H-pyrrol-2-yl)methylene)indolin-2-one; Indolinone based inhibitor, 1; SCHEMBL1162655; SCHEMBL13819612; BDBM17015; MolPort-023-197-743; SEZFNTZQMWJIAI-FLIBITNWSA-N; ZINC3874586; HSCI1_000049; NCGC00343760-01; BRD-K51816706-001-01-7; (3Z)-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one; 3-[(1H-Pyrrole-2-yl)methylene]-1H-indole-2(3H)-one; Z-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-indol-2-one; Oxindole I
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
(E)-3-(4-hydroxybenzylidene)indolin-2-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL103307; (E)-3-(4-hydroxybenzylidene)indolin-2-one; 3-(4-Hydroxybenzylidenyl)indolin-2-one; SCHEMBL16442341; BDBM50131995; ZINC12568108; AKOS001309473; 3-(4-hydroxybenzylidene)indolin-2-one; NCGC00343741-01; ACM293302144; AB00756566-01
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
8-Bromo-3-chloropyrimido[1,6-a]benzimidazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115495; BDBM50448036
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
7-Bromo-4-chloropyrazino[1,2-a]benzimidazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115499; BDBM50448035
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
3-((4-(Dimethylamino)naphthalen-1-yl)methylene)-4-methylindolin-2-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL597960; BDBM50307129
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-(3-Methoxyphenyl)pyrimido[1,6-a]benzimidazol-3-amine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115494; BDBM50448042
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| Activity |
IC50 = 51000 nM
|
[2] | |||
| Compound Name |
N-Phenylpyrimido[1,6-a]benzimidazol-3-amine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115492; BDBM50448041
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| Activity |
IC50 = 52000 nM
|
[2] | |||
| Compound Name |
7-Bromo-N-phenylquinolin-4-amine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4073635; BDBM50246440
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| Activity |
IC50 = 59100 nM
|
[3] | |||
| Compound Name |
8-Bromo-N-phenylpyrimido[1,6-a]benzimidazol-3-amine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115496; BDBM50448040
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| Activity |
IC50 = 69000 nM
|
[2] | |||
| Compound Name |
(8S,16S)-3,16-Dihydroxy-9,10-seco-1,3,5(10)-cholestatrien-9-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL456294; Calicoferol I; USFQLAVWHQCNDG-AYEIPMSGSA-; BDBM50358248; LMST03020180
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| Activity |
IC50 ~ 100000 nM
|
[4] | |||
| Compound Name |
4-Chloropyrazino[1,2-a]benzimidazole
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115498; BDBM50448038
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
4,7-Bis[4-(4-methylpiperazin-1-yl)phenyl]pyrazino[1,2-a]benzimidazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115500; BDBM50448037
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
Calicoferol C
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL515982; BDBM50358249
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| Activity |
IC50 ~ 100000 nM
|
[4] | |||
| Compound Name |
Calicoferol B
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL464351; BDBM50358250
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| Activity |
IC50 ~ 100000 nM
|
[4] | |||
| Compound Name |
3-Chloropyrimido[1,6-a]benzimidazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3115491; BDBM50448039
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
N-Phenylquinolin-4-amine
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Investigative | Compound Info | ||
| Synonyms |
4-anilinoquinoline; 4-Quinolinamine, N-phenyl-; CHEMBL1644358; phenyl-4-quinolylamine; Phenyl-quinolin-4-yl-amine; SCHEMBL170830; CTK1C0243; KS-00002BBU; DTXSID50408552; ZINC5331864; BDBM50246487; STL307624; AKOS005141888; CCG-290214; MCULE-9409324558; SS-4706; DB-110015; ST51070852
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| Activity |
IC50 = 112000 nM
|
[3] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 4 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
5-Chloro-4-N-(2-propan-2-ylsulfonylphenyl)-2-N-(5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepin-2-yl)pyrimidine-2,4-diamine
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3330851; BDBM50025778
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| Activity |
IC50 > 1000000 nM
|
[5] | |||
| Compound Name |
2-[[5-Chloro-2-[[6-(oxetan-3-yl)-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl]amino]pyrimidin-4-yl]amino]-N-methylbenzamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3330857; BDBM50025761
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|
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| Activity |
IC50 > 1000000 nM
|
[5] | |||
| Compound Name |
2-[[5-Chloro-2-[[6-(2H-oxet-3-yl)-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl]amino]pyrimidin-4-yl]amino]-N-methylbenzamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3330856; BDBM50025773
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|
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| Activity |
IC50 > 1000000 nM
|
[5] | |||
| Compound Name |
7-(1-(Piperidin-4-yl)-1h-pyrazol-4-yl)-4-(p-tolyloxy)quinoline
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|
Investigative | Compound Info | ||
| Synonyms |
HS-1371; HS1371; CHEMBL4091441; BCP30268; EX-A2073; HS-1371 pound>>HS 1371; BDBM50246489; s8775; ZB1501; BS-15916; HY-114349; AK00898249; CS-0083312
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| Activity |
Ki = 729046655 nM
|
[3] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Synthesis, structure-activity relationship and crystallographic studies of 3-substituted indolin-2-one RET inhibitors. Bioorg Med Chem. 2010 Feb 15;18(4):1482-96. | ||||
| REF 2 | Synthesis and biological evaluation of benzo[4,5]imidazo[1,2-c]pyrimidine and benzo[4,5]imidazo[1,2-a]pyrazine derivatives as anaplastic lymphoma kinase inhibitors. Bioorg Med Chem. 2014 Feb 15;22(4):1303-12. | ||||
| REF 3 | Identification of 4-Phenoxyquinoline Based Inhibitors for L1196M Mutant of Anaplastic Lymphoma Kinase by Structure-Based Design. J Med Chem. 2017 Nov 22;60(22):9205-9221. | ||||
| REF 4 | 9,10-secosteroids, protein kinase inhibitors from the Chinese gorgonian Astrogorgia sp. Bioorg Med Chem. 2011 Nov 15;19(22):6873-80. | ||||
| REF 5 | Design, synthesis and pharmacological evaluation of 2-(thiazol-2-amino)-4-arylaminopyrimidines as potent anaplastic lymphoma kinase (ALK) inhibitors. Eur J Med Chem. 2014 Oct 30;86:438-48. | ||||
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