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PDB Ligand Accession

Browse small molecules by PDB ligand accession and use Explore to open matching proteins.

37373 molecules found
DrugDomain DataDrugBank IDPDB LigandLigand NameKingdomSuperclassClassSubclass
Exploren/a0G8[(2R,5S)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl]methyl trihydrogen diphosphateOrganic compoundsNucleosides, nucleotides, and analoguesNucleoside and nucleotide analoguesn/a
Exploren/a0GA3-{[(1Z)-1-carboxyprop-1-en-1-yl]oxy}-2-hydroxybenzoic acidOrganic compoundsBenzenoidsBenzene and substituted derivativesPhenoxyacetic acid derivatives
Exploren/a0GD6-[4-({[2-(3-fluorophenyl)ethyl]amino}methyl)phenyl]-4-methylpyridin-2-amineOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPhenylpyridines
Exploren/a0GEN-{[5-(dimethylamino)naphthalen-1-yl]sulfonyl}-L-alpha-glutamyl-N-[(2S,3S)-6-carbamimidamido-1-chloro-2-hydroxyhexan-3-yl]glycinamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0GHN-[(2S)-1-({(2S,3R)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-3-phenylpropan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamideOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoic acids and derivatives
Exploren/a0GI3-(3-hydroxy-3-oxopropyl)-5-(2-methylpropyl)-7-nitro-1H-indole-2-carboxylic acidOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesIndolecarboxylic acids and derivatives
Exploren/a0GJL-alpha-glutamyl-N-{(1S)-4-{[amino(iminio)methyl]amino}-1-[(1S)-2-chloro-1-hydroxyethyl]butyl}glycinamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0GMN-[(5S,9S,10S,13S)-9-hydroxy-5,10-bis(2-methylpropyl)-4,7,12,16-tetraoxo-3,6,11,17-tetraazabicyclo[17.3.1]tricosa-1(23),19,21-trien-13-yl]-3-(naphthalen-1-yl)-2-(naphthalen-1-ylmethyl)propanamideOrganic compoundsOrganic acids and derivativesPeptidomimeticsHybrid peptides
Exploren/a0GO(2S)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-{[3-(propan-2-yl)benzyl]amino}butan-2-yl]-2-[(5S)-6-oxo-1-propyl-1,7-diazaspiro[4.4]non-7-yl]propanamideOrganic compoundsBenzenoidsBenzene and substituted derivativesPhenylbutylamines
Exploren/a0GQ4-amino-N-{(1R,8R,9R,13R)-16-(4-amino-2-methylpyrimidin-5-yl)-1-benzyl-8-(cyclohexylmethyl)-9-hydroxy-13-[(1S)-1-methylpropyl]-2,6,11,14-tetraoxo-3,7,12,15-tetraazahexadec-1-yl}piperidine-1-carboxamideOrganic compoundsOrganic acids and derivativesPeptidomimeticsHybrid peptides
Exploren/a0GRN-(furan-2-ylcarbonyl)-L-leucyl-L-tryptophanOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0GS(3S,4S,5R)-3-(4-amino-3-bromo-5-fluorobenzyl)-5-{[3-(1,1-difluoroethyl)benzyl]amino}tetrahydro-2H-thiopyran-4-ol 1,1-dioxideOrganic compoundsBenzenoidsBenzene and substituted derivativesPhenylmethylamines
Exploren/a0GT(3R,4S,5S)-3-[(3-tert-butylbenzyl)amino]-5-{[3-(2,2-difluoroethyl)-1H-indol-5-yl]methyl}tetrahydro-2H-thiopyran-4-ol 1,1-dioxideOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesIndoles
Exploren/a0GU(3R,4S,5S)-3-[(3-tert-butylbenzyl)amino]-5-[(4,4,7'-trifluoro-1',2'-dihydrospiro[cyclohexane-1,3'-indol]-5'-yl)methyl]tetrahydro-2H-thiopyran-4-ol 1,1-dioxideOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesIndolines
Exploren/a0GV(3beta,8alpha,9beta)-3-hydroxycholest-5-en-7-oneOrganic compoundsLipids and lipid-like moleculesSteroids and steroid derivativesCholestane steroids
Exploren/a0GW5-(1-ethoxyisoquinolin-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-onen/an/an/an/a
Exploren/a0GX{(3-exo)-3-[5-(aminomethyl)-2-fluorophenyl]-8-azabicyclo[3.2.1]oct-8-yl}(4-bromo-3-methyl-5-propoxythiophen-2-yl)methanoneOrganic compoundsAlkaloids and derivativesTropane alkaloidsPhenyltropanes
Exploren/a0GY(1E,3Z)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acidOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesTricarboxylic acids and derivatives
Exploren/a0GZ2-oxo-2H-pyran-4,6-dicarboxylic acidOrganic compoundsOrganoheterocyclic compoundsPyransPyranones and derivatives
Exploren/a0H0Carbohydrate component from a pentavalent N-acetylneuraminic acid conjugaten/an/an/an/a
Exploren/a0H15-ethyl-7-nitro-3-[3-oxidanylidene-3-(thiophen-2-ylsulfonylamino)propyl]-1H-indole-2-carboxylic acidn/an/an/an/a
Exploren/a0H2[1,3-dioxo-6-(pyridin-2-yl-kappaN)-2,3-dihydro-1H-isoindol-5-yl-kappaC~5~][(thioxomethylidene)azanido-kappaN](1,4,7-trithionane-kappa~3~S~1~,S~4~,S~7~)rutheniumOrganic compoundsOrganoheterocyclic compoundsIsoindoles and derivativesIsoindolines
Exploren/a0H37-(6-methoxypyridin-3-yl)-4-{[2-(propan-2-yloxy)ethyl]amino}-1-(2-propoxyethyl)pyrido[4,3-d]pyrimidin-2(1H)-oneOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesBipyridines and oligopyridines
Exploren/a0H4(2S)-3-cyclopentyl-N-(5-methylpyridin-2-yl)-2-[2-oxo-4-(trifluoromethyl)pyridin-1(2H)-yl]propanamideOrganic compoundsOrganic nitrogen compoundsOrganonitrogen compoundsN-arylamides
Exploren/a0H56-methoxy-N-(1-methyl-1H-pyrazol-3-yl)quinazolin-4-amineOrganic compoundsOrganoheterocyclic compoundsDiazanaphthalenesBenzodiazines
ExploreDB117650H66-({(2S)-3-cyclopentyl-2-[4-(trifluoromethyl)-1H-imidazol-1-yl]propanoyl}amino)pyridine-3-carboxylic acidOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPyridinecarboxylic acids and derivatives
Exploren/a0H7(3R)-1-azabicyclo[2.2.2]oct-3-yl[bis(5-chlorothiophen-2-yl)]methanolOrganic compoundsOrganoheterocyclic compoundsQuinuclidinesn/a
Exploren/a0H8N-(3-carboxypropanoyl)-L-valyl-N-[(1R)-5-amino-1-phosphonopentyl]-L-prolinamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0H92-[(4-methoxybenzyl)amino]ethanesulfonic acidOrganic compoundsBenzenoidsBenzene and substituted derivativesPhenylmethylamines
Exploren/a0HD1-(1H-indazol-5-yl)-3-(2-phenylethyl)ureaOrganic compoundsOrganoheterocyclic compoundsBenzopyrazolesIndazoles
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