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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/a0VP3-(5'-{[3,4-bis(hydroxymethyl)benzyl]oxy}-2'-ethyl-2-propylbiphenyl-4-yl)pentan-3-olOrganic compoundsBenzenoidsBenzene and substituted derivativesBiphenyls and derivatives
Exploren/a0VQ(3E,5E)-6-(3-{2-[3,4-bis(hydroxymethyl)phenyl]ethyl}phenyl)-1,1,1-trifluoro-2-(trifluoromethyl)octa-3,5-dien-2-olOrganic compoundsPhenylpropanoids and polyketidesStilbenesn/a
Exploren/a0VR1-(O-carboxy-phenylamino)-1-deoxy-D-ribulose-5-phosphateOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoic acids and derivatives
Exploren/a0VSL-gamma-glutamyl-S-(3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-L-cysteinylglycineOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0VT6-methylhept-5-en-2-oneOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compounds
Exploren/a0VU4-({4-[3-(piperidin-1-ylcarbonyl)phenyl]pyrimidin-2-yl}amino)benzenesulfonamideOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoyl derivatives
Exploren/a0VVN-[(2E)-3,4-dihydroquinazolin-2(1H)-ylidene]sulfuric diamideOrganic compoundsOrganoheterocyclic compoundsDiazanaphthalenesBenzodiazines
Exploren/a0VWN-(tetrahydropyrimidin-2(1H)-ylidene)sulfuric diamideOrganic compoundsOrganoheterocyclic compoundsDiazinesPyrimidines and pyrimidine derivatives
Exploren/a0VXN-[(2Z)-1,3-oxazolidin-2-ylidene]sulfuric diamideOrganic compoundsOrganic acids and derivativesOrganic sulfuric acids and derivativesn/a
Exploren/a0VYN'-sulfamoylpyrrolidine-1-carboximidamideOrganic compoundsOrganic acids and derivativesOrganic sulfuric acids and derivativesn/a
Exploren/a0VZethyl (2Z,4R)-2-(sulfamoylimino)-1,3-thiazolidine-4-carboxylateOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0W0(4R,5S,8Z)-8-(2-amino-1,3-thiazol-4-yl)-1-[3-(1,5-dihydroxy-4-oxo-1,4-dihydropyridin-2-yl)-1,2-oxazol-5-yl]-5-formyl-11,11-dimethyl-1,7-dioxo-4-(sulfoamino)-10-oxa-2,6,9-triazadodec-8-en-12-oic acidOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesCarboxylic acid derivatives
Exploren/a0W11,3-dimethyl-1H-thieno[2,3-c]pyrazole-5-carboxylic acidOrganic compoundsOrganoheterocyclic compoundsThiophenesThiophene carboxylic acids and derivatives
Exploren/a0W21-{(2S)-1-[(3R)-3-(2-chlorophenyl)-2-(2-fluorophenyl)pyrazolidin-1-yl]-1-oxopropan-2-yl}-3-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]ureaOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0W3(4R,6S,8S,12R,14R,16Z,18R,19R,20S,21S)-19,21-dihydroxy-22-{(2S,2'R,5S,5'S)-5'-[(1R)-1-hydroxyethyl]-2,5'-dimethyloctahydro-2,2'-bifuran-5-yl}-4,6,8,12,14,18,20-heptamethyl-9,11-dioxodocos-16-enoic acidOrganic compoundsLipids and lipid-like moleculesPrenol lipidsTerpene glycosides
Exploren/a0W4~{N}-[(2-chlorophenyl)methyl]-3-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamideOrganic compoundsOrganoheterocyclic compoundsDiazinesPyrazines
Exploren/a0W72-[4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]-N-phenylacetamideOrganic compoundsBenzenoidsBenzene and substituted derivativesAnilides
Exploren/a0W81-ethyl-1,3-dihydro-2H-benzimidazol-2-oneOrganic compoundsOrganoheterocyclic compoundsBenzimidazolesn/a
Exploren/a0WA4-fluoro-2-{[4-(pyridin-4-yl)-1,3-thiazol-2-yl]amino}phenolOrganic compoundsBenzenoidsPhenolsHalophenols
Exploren/a0WB3-{2-[(5-fluoro-2-hydroxyphenyl)amino]-1,3-thiazol-4-yl}benzonitrileOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzonitriles
Exploren/a0WC(2R)-4-[1-(2-amino-5-chloropyrimidin-4-yl)-2,3-dihydro-1H-indol-6-yl]-2-(1,3-thiazol-2-yl)but-3-yn-2-olOrganic compoundsOrganic nitrogen compoundsOrganonitrogen compoundsAmines
Exploren/a0WD[[(2R,3S,4R,5R)-5-(3-aminocarbonyl-4H-pyridin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphateOrganic compoundsNucleosides, nucleotides, and analogues(5'->5')-dinucleotidesn/a
Exploren/a0WEN-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-(7-oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-3-yl)propanamideOrganic compoundsOrganoheterocyclic compoundsDiazanaphthalenesNaphthyridines
Exploren/a0WF1-cyclopentyl-6-[(1R)-1-(3-phenoxyazetidin-1-yl)ethyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-oneOrganic compoundsOrganoheterocyclic compoundsPyrazolopyrimidinesPyrazolo[3,4-d]pyrimidines
Exploren/a0WG7-amino-6-(aminomethyl)-5-(2-bromophenyl)-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4(1H,3H)-dioneOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPhenylpyridines
Exploren/a0WH1-[5-(4-amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-2,3-dihydro-1H-indol-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanoneOrganic compoundsOrganoheterocyclic compoundsIndoles and derivativesPhenylacetylindoles
Exploren/a0WK1,5-anhydro-6-O-phosphono-D-glucitolOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbohydrates and carbohydrate conjugates
Exploren/a0WL1-cyclopentyl-6-{(1R)-1-[3-(pyrimidin-2-yl)azetidin-1-yl]ethyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-oneOrganic compoundsOrganoheterocyclic compoundsPyrazolopyrimidinesPyrazolo[3,4-d]pyrimidines
ExploreDB089160WM(2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamideOrganic compoundsOrganoheterocyclic compoundsDiazanaphthalenesBenzodiazines
Exploren/a0WNN-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)butanamideOrganic compoundsOrganoheterocyclic compoundsDiazanaphthalenesBenzodiazines
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