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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/a0KY3-[(2R)-2-ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-oneOrganic compoundsOrganoheterocyclic compoundsImidazopyrimidinesPurines and purine derivatives
Exploren/a0L0(4-{[(6-benzyl-1-hydroxy-7-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)amino]methyl}-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphateOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPyridoxamines
Exploren/a0L1hexanedioic acidOrganic compoundsLipids and lipid-like moleculesFatty AcylsFatty acids and conjugates
Exploren/a0L37-{2-deoxy-5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-erythro-pentofuranosyl}-5-{5-[(10-hydroxydecanoyl)amino]pent-1-yn-1-yl}-7H-pyrrolo[2,3-d]pyrimidin-4-amineOrganic compoundsOrganoheterocyclic compoundsPyrrolopyrimidinesPyrrolo[2,3-d]pyrimidines
Exploren/a0L45-(5-aminopent-1-yn-1-yl)-7-{2-deoxy-5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-erythro-pentofuranosyl}-7H-pyrrolo[2,3-d]pyrimidin-4-amineOrganic compoundsOrganoheterocyclic compoundsPyrrolopyrimidinesPyrrolo[2,3-d]pyrimidines
Exploren/a0L52'-deoxy-5-{5-[(10-hydroxydecanoyl)amino]pent-1-yn-1-yl}uridine 5'-(tetrahydrogen triphosphate)Organic compoundsNucleosides, nucleotides, and analoguesPyrimidine nucleotidesPyrimidine deoxyribonucleotides
Exploren/a0L65-(5-aminopent-1-yn-1-yl)-2'-deoxycytidine 5'-(tetrahydrogen triphosphate)Organic compoundsNucleosides, nucleotides, and analoguesPyrimidine nucleotidesPyrimidine deoxyribonucleotides
Exploren/a0L72-amino-5-(5-aminopent-1-yn-1-yl)-7-{2-deoxy-5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-erythro-pentofuranosyl}-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-oneOrganic compoundsOrganoheterocyclic compoundsPyrrolopyrimidinesPyrrolo[2,3-d]pyrimidines
Exploren/a0L82'-bromo-6'-(furan-3-yl)-4'-(hydroxymethyl)biphenyl-4-olOrganic compoundsBenzenoidsBenzene and substituted derivativesBiphenyls and derivatives
Exploren/a0L9(2S)-[6-bromo-4-(4-chlorophenyl)-2-methylquinolin-3-yl](methoxy)ethanoic acidOrganic compoundsOrganoheterocyclic compoundsQuinolines and derivativesPhenylquinolines
Exploren/a0LA(2S)-2-(6-chloro-9H-carbazol-2-yl)propanoic acidOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesCarbazoles
Exploren/a0LB(1R,2R)-N-(1-cyanocyclopropyl)-2-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}cyclohexanecarboxamideOrganic compoundsOrganoheterocyclic compoundsDiazinanesPiperazines
Exploren/a0LC(1R,2R)-N-(1-cyanocyclopropyl)-2-[(8-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)carbonyl]cyclohexanecarboxamideOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesIndoles
Exploren/a0LD(5-hydroxy-4-{[(7-hydroxy-6-oxo-2-phenyl-6,7-dihydro-2H-pyrazolo[3,4-b]pyridin-5-yl)amino]methyl}-6-methylpyridin-3-yl)methyl dihydrogen phosphateOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPyridoxamines
Exploren/a0LGN-[(4S,8E,11S)-4-[(1R)-1-hydroxy-2-{[3-(propan-2-yl)benzyl]amino}ethyl]-2,13-dioxo-11-phenyl-6-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraen-16-yl]-N-methylmethanesulfonamideOrganic compoundsPhenylpropanoids and polyketidesMacrolactamsn/a
Exploren/a0LH2-(1H-indol-1-yl)ethanamineOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesN-alkylindoles
ExploreDB089010LI3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}benzam ideOrganic compoundsBenzenoidsBenzene and substituted derivativesAnilides
Exploren/a0LJN-[(1R,2R)-2-carbamimidamido-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0LKN-[(1S,2S)-2-carbamimidamido-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0LLN-[(1S,2S)-2-amino-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0LMN-(4-chloro-3-fluorophenyl)-N'-(1,2,2,6,6-pentamethylpiperidin-4-yl)ethanediamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0LN13-cyclohexyl-3-methoxy-17,22-dimethyl-7H-10,6-(methanoiminothioiminobutanoiminomethano)indolo[2,1-a][2]benzazepine-14,23-dione 16,16-dioxideOrganic compoundsPhenylpropanoids and polyketidesMacrolactamsn/a
Exploren/a0LO5-phenylpyridine-3-carboxylic acidOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPhenylpyridines
Exploren/a0LP5-acetamido-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acidOrganic compoundsBenzenoidsBenzene and substituted derivativesStyrenes
Exploren/a0LQ(4aS,7aS)-1,4-bis(diphenylmethyl)hexahydro-1H-pyrrolo[3,4-b]pyrazine-2,3-dioneOrganic compoundsBenzenoidsBenzene and substituted derivativesDiphenylmethanes
Exploren/a0LR(3R,4R)-3-(naphthalen-2-ylmethoxy)-4-phenylpiperidineOrganic compoundsOrganoheterocyclic compoundsPiperidinesPhenylpiperidines
Exploren/a0LSN-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-chloro-N-phenylanilineOrganic compoundsOrganic nitrogen compoundsOrganonitrogen compoundsAmines
Exploren/a0LTN-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-methoxy-3-(3-methoxypropoxy)-N-(propan-2-yl)benzamideOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoic acids and derivatives
Exploren/a0LU(2S)-1-(pyrrolidin-1-yl)-3-(9H-thioxanthen-9-yl)propan-2-olOrganic compoundsOrganoheterocyclic compoundsBenzothiopyrans1-benzothiopyrans
Exploren/a0LV(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)methanolOrganic compoundsOrganoheterocyclic compoundsCoumaransn/a
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