Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T02546 | Target Info | |||
| Target Name | Voltage-gated sodium channel alpha Nav1.4 (SCN4A) | ||||
| Synonyms |
Voltage-gated sodium channel subunit alpha Nav1.4; Sodium channel protein type IV subunit alpha; Sodium channel protein skeletal muscle subunit alpha; SkM1; SCN4A
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| Target Type | Clinical trial Target | ||||
| Gene Name | SCN4A | ||||
| Biochemical Class | Voltage-gated ion channel | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 8 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Carbamazepine
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Approved | Compound Info | ||
| Synonyms |
Carbamazepine (iv, epilepsy); Carbamazepine (iv, epilepsy), Lundbeck; Carbamazepine (iv, epilepsy), Ovation Pharmaceuticals
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| Activity |
Ki = 52000 nM
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[1] | |||
| Compound Name |
CID 127046597
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3798460; BDBM50163915
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| Activity |
IC50 ~ 50000 nM
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[2] | |||
| Compound Name |
N-[[5-[1-(2-Imidazol-1-ylethyl)indazol-3-yl]-1,2,4-oxadiazol-3-yl]methyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3236343; SCHEMBL1768467; BDBM50008746; N-((5-(1-(2-(1H-imidazol-1-yl)ethyl)-1H-indazol-3-yl)-1,2,4-oxadiazol-3-yl)methyl)benzamide; N-[5-[1-[2-(1H-Imidazole-1-yl)ethyl]-1H-indazole-3-yl]-1,2,4-oxadiazole-3-ylmethyl]benzamide
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| Activity |
IC50 = 56000 nM
|
[3] | |||
| Compound Name |
3-Phenyl-1H-pyrazole
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Investigative | Compound Info | ||
| Synonyms |
3-Phenylpyrazole; 5-phenyl-1H-pyrazole; 1H-Pyrazole, 3-phenyl-; 3-Phenylpyrazol; PYRAZOLE, 3-PHENYL-; phenylpyrazole; MFCD00159654; CHEMBL38876; Q63398285; 3(5)-Phenyl-1H-pyrazole, 99+%; 3(5)-phenyl-1h-pyrazole; 5-phenylpyrazole; 3-phenyl-pyrazole; 3-Phenyl pyrazole; 3(5)-phenylpyrazole; PubChem10422; 3-Phenyl-1H-pyrazole #; SCHEMBL9438; KSC201S1N; 3-Phenyl-1H-pyrazole, 97%; CTK1A1916; DTXSID40179320; ACT06758; ALBB-005415; BCP25611; KS-00000NP6; ZINC9238252; ANW-25482; BBL012454; BDBM50078831; CL3440; SBB023350; STK097634; AKOS000313117; AKOS000345348; ACN-000345; AM80878; AS-5622; CS-W002461; LS20162; MCULE-9865969061; QC-4492; VP20088; NCGC00331164-01; AC-23138; AK-39279; SC-81108; SY009071; AB0003395; DB-011228; A5050; BB 0237722; FT-0616352; P2063; ST50681581; EN300-62492; Y-9188; 12707-EP2274983A1; 12707-EP2295402A2; 12707-EP2308858A1; 12707-EP2311816A1; 12707-EP2311817A1; 12707-EP2316831A1; 12707-EP2374791A1; AB01205810-03; J-513034; J-640158; J-800161; F1667-0020; Z1224534135
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| Activity |
Ki = 61000 nM
|
[1] | |||
| Compound Name |
(2S)-N-(2,6-Dimethylphenyl)-N-methylpyrrolidine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL484996; BDBM50413848; ZINC13814047
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| Activity |
EC50 = 67608.3 nM
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[4] | |||
| Compound Name |
(2R)-N-(2,6-Dimethylphenyl)-1-methylpyrrolidine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL473705; BDBM50413845; ZINC13814037
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| Activity |
EC50 = 67608.3 nM
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[4] | |||
| Compound Name |
3-(4-Methoxyphenyl)-1H-pyrazole
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Investigative | Compound Info | ||
| Synonyms |
3-(4-Methoxyphenyl)Pyrazole; 5-(4-Methoxyphenyl)-1H-pyrazole; CHEMBL39210; 3-(4-Methoxy-phenyl)-1H-pyrazole; 5-(4-METHOXYPHENYL)PYRAZOLE; MFCD00112008; 4-methoxy-1-pyrazol-3-ylbenzene; 3-(4-methoxyphenyl)pyrazole, AldrichCPR; 1H-Pyrazole, 3-(4-methoxyphenyl)-; Maybridge1_007801; 3-(4-methoxyphenyl)-pyrazole; SCHEMBL1186499; CTK4F9045; CTK7A3167; HMS563K13; DTXSID40344859; Pyrazole, 5-(4-methoxyphenyl)-; KS-00001OM3; ZINC9238256; 1H-Pyrazole,3-(4-methoxyphenyl)-; 3-(4-Methoxyphenyl)pyrazole, 98%; ANW-26121; BBL028210; BDBM50141063; SBB059634; STK305223; 5-(4-Methoxyphenyl)-1H-pyrazole #; AKOS000345379; AKOS002658113; MCULE-9803809319; NCGC00339497-01; SC-62553; SY152004; AB0048453; DB-025970; FT-0705891; ST45073364; A-8042; AB01332549-02; 2Y-0829; A818901; J-016669
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| Activity |
Ki = 81000 nM
|
[1] | |||
| Compound Name |
(2S)-N-(2,6-Dimethylphenyl)-N,1-dimethylpyrrolidine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL485002; BDBM50413850
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| Activity |
EC50 = 199526.23 nM
|
[4] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 8 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Ketamine
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Approved | Compound Info | ||
| Synonyms |
Calypsol; Cetamina; Green; Ketaject; Ketalar; Ketaminum; Ketanest; Ketoject; Ketolar; Tekam; KETAMINE HCL; Ketalar base; Ketamine Base; Special K; Special K [street name]; CLSTA 20; T385; Cetamina [INN-Spanish]; Dl-Ketamine; Ketalar (TN); Ketamine (INN); Ketamine [INN:BAN]; Ketaminum [INN-Latin]; Ketanest (TN); Ketaset (TN); Tekam (TN); Cyclohexanone, 2-(2-chlorophenyl)-2-(methylamino)-(9CI); Cyclohexanone, 2-(2-chlorophenyl)-2-(methylamino)-, (+-)-(9CI); Cyclohexanone, 2-(o-chlorophenyl)-2-(methylamino)-, (+/-)-(8CI); (+/-)-2-(2-Chlorophenyl)-2-(methylamino)cyclohexanone; (+/-)-2-(o-Chlorophenyl)-2-(methylamino)cyclohexanone; 2-(2-Chlorophenyl)-2-(methylamino)cyclohexanone; 2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one; 2-(Methylamino)-2-(2-chlorophenyl)cyclohexanone; 2-(o-Chlorophenyl)-2-(methylamino)-cyclohexanone; 2-(o-Chlorophenyl)-2-(methylamino)cyclohexanone
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| Activity |
IC50 = 800000 nM
|
[5] | |||
| Compound Name |
(2R)-1-Phenoxypropan-2-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2021482; (r)-1-phenoxy-2-propanol; SCHEMBL3254859; ZINC391850; BDBM50413863; AKOS020829253; J-505049; UNII-87CZY0NY1A component IBLKWZIFZMJLFL-MRVPVSSYSA-N
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| Activity |
EC50 = 208929.61 nM
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[4] | |||
| Compound Name |
(2R)-N-(2,6-Dimethylphenyl)-N-methylpyrrolidine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL484981; BDBM50413847; ZINC13814044
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| Activity |
EC50 = 218776.16 nM
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[4] | |||
| Compound Name |
Propanamide, 2-amino-N-(2,6-dimethylphenyl)-, (S)-
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL387108; (S)-Tocainide; (+)-Tocainide; Prestwick-13G08; S-TOCAINIDE; NCGC00017005-01; SCHEMBL308742; ZINC2283; BDBM50291989; (S)-2-amino-N-(2,6-dimethylphenyl)propanamide; UNII-27DXO59SAN component BUJAGSGYPOAWEI-VIFPVBQESA-N; (S)-2-Amino-N-(2,6-dimethyl-phenyl)-propionamide(tocainide)
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| Activity |
EC50 = 223872.11 nM
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[4] | |||
| Compound Name |
(S)-1-Phenoxy-2-Propanol
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Investigative | Compound Info | ||
| Synonyms |
(2S)-1-phenoxypropan-2-ol; CHEMBL2021481; (S)-phenoxy-2-propanol; (2S)-1-phenoxy-2-propanol; (S)-1-Phenoxy-propan-2-ol; SCHEMBL2943775; (+)-(s)-1-phenoxy-2-propanol; ZINC391849; BDBM50413864; AKOS017515549; A838947; UNII-87CZY0NY1A component IBLKWZIFZMJLFL-QMMMGPOBSA-N
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| Activity |
EC50 = 234422.88 nM
|
[4] | |||
| Compound Name |
(R)-2-Amino-N-(2,6-dimethylphenyl)propanamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL222944; R(-)-Tocainide; ZINC786; BIDD:GT0546; Propanamide, 2-amino-N-(2,6-dimethylphenyl)-, (2R)-; BDBM50291990; AKOS017426502; 2-Amino-N-(2,6-dimethyl-phenyl)-propionamide; UNII-27DXO59SAN component BUJAGSGYPOAWEI-SECBINFHSA-N; (R)-2-Amino-N-(2,6-dimethyl-phenyl)-propionamide(tocainide)
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| Activity |
EC50 = 275422.87 nM
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[4] | |||
| Compound Name |
(7Ar)-2-(2,6-dimethylphenyl)-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c]imidazol-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL501346; BDBM50413855
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| Activity |
EC50 = 501187.23 nM
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[4] | |||
| Compound Name |
(2R)-N-(2,6-Dimethylphenyl)-N,1-dimethylpyrrolidine-2-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL484833; BDBM50413849
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| Activity |
EC50 = 501187.23 nM
|
[4] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | 3-(4-phenoxyphenyl)pyrazoles: a novel class of sodium channel blockers. J Med Chem. 2004 Mar 11;47(6):1547-52. | ||||
| REF 2 | Single Residue Substitutions That Confer Voltage-Gated Sodium Ion Channel Subtype Selectivity in the NaV1.7 Inhibitory Peptide GpTx-1. J Med Chem. 2016 Mar 24;59(6):2704-17. | ||||
| REF 3 | Imidazol-1-ylethylindazole voltage-gated sodium channel ligands are neuroprotective during optic neuritis in a mouse model of multiple sclerosis. J Med Chem. 2014 Apr 10;57(7):2942-52. | ||||
| REF 4 | 2D- and 3D-QSAR of tocainide and mexiletine analogues acting as Na(v)1.4 channel blockers. Eur J Med Chem. 2009 Apr;44(4):1477-85. | ||||
| REF 5 | Design, synthesis, and evaluation of analogues of 3,3,3-trifluoro-2-hydroxy-2-phenyl-propionamide as orally available general anesthetics. J Med Chem. 2003 Jun 5;46(12):2494-501. | ||||
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