Ligand clusters for UniProt code P47811

Ligand clusters for P47811: Mitogen-activated protein kinase 14 from Mus musculus

		Top 6 (of 29) ligand clusters Cluster 1. 63 ligand types 129 ligands Cluster 2. 27 ligand types 105 ligands Cluster 3. 6 ligand types 6 ligands Cluster 4. 12 ligand types 19 ligands Cluster 5. 5 ligand types 6 ligands Cluster 6. 3 ligand types 42 ligands
Representative protein: 4loqA

Structures

PDB		Schematic diagram
4loqA
5r8yA
5r9rA
5ra8A
5r9uA
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Cluster 1 contains 63 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
		1. Ligand: DMS × 1 dimethyl sulfoxide Dimethyl sulfoxide PDB code: 5r8u(A).
		2. Ligand: SFY × 1 sulfapyridine 4-Amino-N-(Pyridin-2-Yl)benzenesulfonamide PDB code: 5r9p(A).
_Mg		3. Metal: _MG × 1 PDB code: 5nzz(E).
		4. Ligand: LID × 1 8-(2-Chlorophenylamino)-2-(2,6-Difluorophenylamino)-9- Ethyl-9h-Purine-1,7-Diium PDB code: 2gtm(A).
		5. Ligand: LI9 × 1 4-(4-Fluorophenyl)-1-Methyl-5-(2-{[(1s)-1- Phenylethyl]amino}pyrimidin-4-Yl)-2-Piperidin-4-Yl- 1, 2-Dihydro-3h-Pyrazol-3-One PDB code: 1ywr(A).
		6. Ligand: LIB × 1 3-(2-Chlorophenyl)-1-(2-{[(1s)-2-Hydroxy-1,2- Dimethylpropyl]amino}pyrimidin-4-Yl)-1-(4- Methoxyphenyl)urea PDB code: 2ghl(A).
		7. Ligand: LIC × 1 3-(2-Chlorobenzyl)-1-(2-{[(1s)-2-Hydroxy-1,2- Dimethylpropyl]amino}pyrimidin-4-Yl)-1-(4- Methoxyphenyl)urea PDB code: 2ghm(A).
		8. Ligand: PGJ × 1 2-(Ethoxymethyl)-4-(4-Fluorophenyl)-3-[2-(2- Hydroxyphenoxy)pyrimidin-4-Yl]isoxazol-5(2h)-One PDB code: 1yw2(A).
		9. Ligand: SO4 × 42 Sulfate ion PDB codes: 5r8u(A), 5r8v(A), 5r8y(A), 5r8z(A), 5r93(A), 5r95(A), 5r96(A), 5r97(A), 5r98(A), 5r9a(A), 5r9b(A), 5r9d(A), 5r9e(A), 5r9f(A), 5r9h(A), 5r9i(A), 5r9k(A), 5r9m(A), 5r9n(A), 5r9t(A), 5r9z(A), 5ra1(A), 5ra8(A), 6so1(A), 6so2(A), 6so4(A), 6sod(A), 6soi(A), 6sot(A).
		10. Ligand: SB4 × 18 4-(4-Fluorophenyl)-1-(4-Piperidinyl)-5-(2-Amino-4- Pyrimidinyl)-Imidazole PDB codes: 4loo(A), 4lop(A), 4loq(A), 5o90(A), 6sov(A), 6sp9(A), 6spl(A), 6y7w(A), 6y7x(A), 6y7y(A), 6y7z(A), 6y80(A), 6y81(A), 6y82(A), 6y85(A), 6y8h(A), 6ycu(A), 6ycw(A).
		11. Ligand: ACT × 6 Acetate ion PDB codes: 5r8z(A), 5r90(A), 5r91(A), 5r92(A), 5r94(A), 5r9c(A).
		12. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 4lop(A), 7bdq(A).
		13. Ligand: JFS × 2 [4-(1h-Benzimidazol-1-Yl)phenyl]methanol PDB codes: 5r9n(A), 5ra0(A).
		14. Ligand: SU7 × 2 3-Oxidanylidene-3-[4-(Phenylmethyl)piperidin-1- Yl]propanenitrile PDB codes: 5r99(A), 5r9y(A).
		15. Ligand: 2O6 × 1 5-(Trifluoromethyl)-1,2-Benzoxazol-3-Amine PDB code: 5ra8(A).
		16. Ligand: 39G × 1 N-[5-(Dimethylsulfamoyl)-2-Methylphenyl]-1-Phenyl-5- Propyl-1h-Pyrazole-4-Carboxamide PDB code: 4tyh(B).
		17. Ligand: 6SH × 1 5-Azanyl-~{N}-[[4-[[(2~{s})-1-Azanyl-4-Cyclohexyl-1- Oxidanylidene-Butan-2- Yl]carbamoyl]phenyl]methyl]-1- Phenyl-Pyrazole-4-Carboxamide PDB code: 5lar(A).
		18. Ligand: AGS × 1 Phosphothiophosphoric acid-Adenylate ester PDB code: 5nzz(E).
		19. Ligand: G2G × 1 5-Tert-Butyl-2-(4-Methylphenyl)-3-{[({4-[6-(Morpholin- 4-Ylmethyl)pyridin-3-Yl]-1- Naphthyl}amino) carbonyl]amino}-1h-Pyrazol-2-Ium PDB code: 2puu(A).
		20. Ligand: JMM × 1 [4-(Cyclopropanecarbonyl)piperazin-1-Yl](furan-2-Yl) methanone PDB code: 5r9u(A).
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Cluster 2 contains 27 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
		1. Ligand: DMS × 3 dimethyl sulfoxide Dimethyl sulfoxide PDB codes: 5r96(A), 6sp9(A),
		2. Ligand: 308 × 1 amantadine (3s,5s,7s)-Tricyclo[3.3.1.1~3,7~]decan-1-Amine PDB code: 6y82(A).
		3. Ligand: SO4 × 61 Sulfate ion PDB codes: 5r8u(A), 5r8v(A), 5r8w(A), 5r8x(A), 5r8y(A), 5r8z(A), 5r90(A), 5r91(A), 5r92(A), 5r93(A), 5r94(A), 5r95(A), 5r96(A), 5r98(A), 5r99(A), 5r9a(A), 5r9b(A), 5r9c(A), 5r9d(A), 5r9e(A), 5r9f(A), 5r9g(A), 5r9h(A), 5r9i(A), 5r9j(A), 5r9k(A), 5r9l(A), 5r9m(A), 5r9n(A), 5r9o(A), 5r9p(A), 5r9q(A), 5r9r(A), 5r9s(A), 5r9t(A), 5r9u(A), 5r9v(A), 5r9w(A), 5r9x(A), 5r9y(A), 5r9z(A), 5ra0(A), 5ra1(A), 5ra2(A), 5ra3(A), 5ra4(A), 5ra5(A), 5ra6(A), 5ra7(A), 5ra8(A), 5ra9(A), 6so1(A), 6so4(A), 6sod(A), 6soi(A), 6sot(A), 6sou(A), 6sov(A), 6y7z(A), 6y80(A), 6y85(A).
		4. Ligand: EDO × 12 1,2-Ethanediol PDB codes: 4lop(A), 5r95(A), 5r99(A), 5r9i(A), 6sot(A), 6y4t(A), 6y4v(A), 6y4w(A), 6yk7(A), 7be5(A),
		5. Ligand: LOT × 3 6-[2,5-Bis(oxidanylidene)pyrrolidin-1-Yl]pyridine-3- Sulfonamide PDB codes: 6sov(A), 6sp9(A), 6y7y(A).
		6. Ligand: A7K × 2 [2-[4-(Hydroxymethyl)piperidin-1- Yl]phenyl]methylazanium PDB codes: 5r9m(A),
		7. Ligand: LOW × 2 (5~{s},7~{r})-3-Azanyladamantan-1-Ol PDB codes: 6sov(A), 6spl(A).
		8. Ligand: OFQ × 2 (2-Azanyl-2-Adamantyl)methanol PDB codes: 6y7x(A), 6y7y(A).
		9. Ligand: LO5 × 1 1-(1,3-Benzodioxol-5-Yl)-~{N}-[[(2~{r})-Oxolan-2- Yl]methyl]methanamine PDB code: 6so1(A).
		10. Ligand: LO8 × 1 (2~{s})-2-Methyl-4-(Oxetan-3-Yl)-~{N}-(Phenylmethyl) piperazine-2-Carboxamide PDB code: 6so4(A).
		11. Ligand: LOE × 1 1-[[(3~{s})-1,4-Dioxaspiro[4.5]decan-3- Yl]methyl]piperidine PDB code: 6sod(A).
		12. Ligand: LOK × 1 Methyl ~{n}-[3-(Methoxycarbonylamino)phenyl]carbamate PDB code: 6soi(A).
		13. Ligand: LOQ × 1 1-(4-Methylphenyl)pyrrolidine-2,5-Dione PDB code: 6sot(A).
		14. Ligand: LPZ × 1 2-(4-Methylphenoxy)-1-(4-Methylpiperazin-4-Ium-1-Yl) ethanone PDB code: 6sou(A).
		15. Ligand: NZ4 × 1 N-(3-Acetylphenyl)morpholine-4-Carboxamide PDB code: 5r9x(A).
		16. Ligand: OFW × 1 (2~{r})-~{N}-[(2-Azanyl-2-Adamantyl)methyl]-4-[6-[2,5- Bis(oxidanylidene)pyrrolidin-1-Yl]pyridin-3- Yl]sulfonyl-2-Methyl-Morpholine-2-Carboxamide PDB code: 6y7w(A).
		17. Ligand: OFZ × 1 1-(2-Adamantylmethyl)-3-Ethyl-Guanidine PDB code: 6y80(A).
		18. Ligand: OG2 × 1 1-(1-Adamantyl)-3-Ethyl-Guanidine PDB code: 6y7z(A).
		19. Ligand: OG5 × 1 (3~{r})-~{N}-[(2-Azanyl-2-Adamantyl)methyl]-3-[[6-[2,5- Bis(oxidanylidene)pyrrolidin-1-Yl]pyridin- 3- Yl]sulfonylamino]-3-Phenyl-Propanamide PDB code: 6y81(A).
		20. Ligand: OG8 × 1 1-(1-Adamantylmethyl)guanidine PDB code: 6y85(A).
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Cluster 3 contains 6 ligand types

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Ligand		Description
		1. Ligand: LYS-LYS-ASP-LEU-ARG-ILE-SER-CYS × 1 PDB code: 1lez(A).
		2. Ligand: LYS-PRO-ASP-LEU-ARG-VAL-VAL-ILE-PRO-PRO × 1 PDB code: 1lew(A).
		3. Ligand: RGY × 1 (4r,4as,7as,9s)-3,10-Dimethyl-5,6,7,7a,8,9-Hexahydro- 4h-4a,9- Epiminopyrrolo[3',4':5,6]cyclohepta[1,2-D][1, 2]oxazol-4-Ol PDB code: 5r9g(A).
		4. Ligand: SVD × 1 (5~{r})-5-~{Tert}-Butyl-2-Methyl-1-Oxidanyl- Pyrazolidin-3-One PDB code: 5ra3(A).
		5. Ligand: SVG × 1 (~{E})-1-(4-Chlorophenyl)-~{N}-(Pyridin-3-Ylmethyl) ethanimine PDB code: 5ra4(A).
		6. Ligand: THR-LEU-SER-LEU-VAL-MET-PRO-SER × 1 PDB code: 4ka3(A).

Cluster 4 contains 12 ligand types

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Ligand		Description
		1. Ligand: BOG × 6 Octyl beta-D-Glucopyranoside PDB codes: 3p5k(A), 3p78(A), 3p79(A), 3p7a(A), 3p7b(A), 3p7c(A).
		2. Ligand: EDO × 3 1,2-Ethanediol PDB codes: 6y4t(A), 6y4v(A), 6yk7(A).
		3. Ligand: 54F × 1 3-(Pyridin-2-Yloxy)aniline PDB code: 5r9o(A).
		4. Ligand: 6T5 × 1 6-Methyl-5-[(4-Propan-2-Ylphenyl)amino]-2~{h}-1,2,4- Triazin-3-One PDB code: 5r9t(A).
		5. Ligand: A9B × 1 5-(4-Chlorophenyl)furan-2-Carbohydrazide PDB code: 5r9s(A).
		6. Ligand: AYS × 1 2-[(4-Chlorophenyl)amino]benzamide PDB code: 5r9z(A).
		7. Ligand: JND × 1 6-Ethylthieno[2,3-D]pyrimidin-4(3h)-One PDB code: 5r8w(A).
		8. Ligand: SLV × 1 ~{N}-(3-Oxidanyl-4-Propyl-Phenyl)ethanamide PDB code: 5r8v(A).
		9. Ligand: SOJ × 1 ~{N}4-Phenylbenzene-1,4-Diamine PDB code: 5r93(A).
		10. Ligand: SQG × 1 2-Cyano-~{N}-[4-(Trifluoromethyloxy)phenyl]ethanamide PDB code: 5r98(A).
		11. Ligand: SQM × 1 4-Benzamido-2-Methyl-Pyrazole-3-Carboxamide PDB code: 5r9a(A).
		12. Ligand: SSY × 1 ~{N}-(3-Ethanoylphenyl)-2,2,2-Tris(fluoranyl)ethanamide PDB code: 5r9v(A).

Cluster 5 contains 5 ligand types

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Ligand		Description
		1. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 6y4x(A), 7bdq(A).
		2. Ligand: 7ZC × 1 1-(5-Methoxy-1h-Indol-3-Yl)-N,N-Dimethyl-Methanamine PDB code: 5r9c(A).
		3. Ligand: LOW × 1 (5~{s},7~{r})-3-Azanyladamantan-1-Ol PDB code: 6spl(A).
		4. Ligand: SNV × 1 2-[4-(2-Aminophenyl)piperazin-1-Yl]ethanol PDB code: 5r91(A).
		5. Ligand: SQP × 1 2-(4-Aminophenyl)benzoic acid PDB code: 5r9f(A).

Cluster 6 contains 3 ligand types

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Ligand		Description
		1. Ligand: DMS × 39 dimethyl sulfoxide Dimethyl sulfoxide PDB codes: 5r8u(A), 5r8v(A), 5r8w(A), 5r8x(A), 5r8y(A), 5r91(A), 5r92(A), 5r93(A), 5r94(A), 5r98(A), 5r99(A), 5r9b(A), 5r9e(A), 5r9f(A), 5r9g(A), 5r9i(A), 5r9j(A), 5r9k(A), 5r9o(A), 5r9p(A), 5r9r(A), 5r9s(A), 5r9u(A), 5r9v(A), 5r9w(A), 5r9x(A), 5r9y(A), 5r9z(A), 5ra0(A), 5ra1(A), 5ra2(A), 5ra3(A), 5ra4(A), 5ra5(A), 5ra6(A), 5ra8(A), 5ra9(A), 6sod(A), 6soi(A).
		2. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 6y4u(A), 6yk7(A).
		3. Ligand: JGG × 1 N-[(4-Cyanophenyl)methyl]morpholine-4-Carboxamide PDB code: 6so2(A).