Top chemical compounds for concept: c_0185
# Observed top chemical compounds associated with the concept c_0185
# mined from the 'HETATM' record lines within the wwPDB
# coordinate files of this concept's usages.
# -------------------------------------------------------------c_0185
# %Freq Ligand/Chemical Compound
# -------------------------------------------------------------------
23.6 21 SO4 SULFATE ION
22.5 20 GOL GLYCEROL
7.9 7 NAG N-ACETYL-D-GLUCOSAMINE
5.6 5 PG4 TETRAETHYLENE GLYCOL
5.6 5 ACT ACETATE ION
4.5 4 PGE TRIETHYLENE GLYCOL
4.5 4 NOW NALPHA-[(3-TERT-BUTYL-1-METHYL-1H-PYRAZOL-5-YL)CARBONYL]-N-[(2Z)-2-IMINOETHYL]-3-METHYL-L-PHENYLALANINAMIDE
4.5 4 8PW (2S,4R)-N-(1-CYANOCYCLOPROPYL)-1-(1-METHYLCYCLOPROPANECARBONYL)-4-[4-(2,2,2-TRIFLUOROETHOXY)-2-(TRIFLUOROMETHYL)PHENYL]SULFONYLPYRROLIDINE-2-CARBOXAMIDE
3.4 3 THJ THIOSULFATE
3.4 3 NA SODIUM ION
3.4 3 EDO 1,2-ETHANEDIOL
3.4 3 E64 N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-BUTYL]-GUANIDINE
3.4 3 DMS DIMETHYL SULFOXIDE
3.4 3 CL CHLORIDE ION
3.4 3 BMA BETA-D-MANNOSE
3.4 3 424 (2S,4R)-1-[1-(4-CHLOROPHENYL)CYCLOPROPYL]CARBONYL-4-(2-CHLOROPHENYL)SULFONYL-N-[1-(IMINOMETHYL)CYCLOPROPYL]PYRROLIDINE-2-CARBOXAMIDE
3.4 3 3H5 N-(1H-benzimidazol-2-yl)-1,3-dimethyl-1H-pyrazole-4-carboxamide
3.4 3 2EW (3S,4S)-N-[(2E)-2-IMINOETHYL]-4-(MORPHOLIN-4-YLCARBONYL)-1-(PHENYLSULFONYL)PYRROLIDINE-3-CARBOXAMIDE
2.2 2 V65 4-[(4-CHLOROBENZYL)(CYCLOHEXYL)AMINO]-6-MORPHOLIN-4-YL-1,3,5-TRIAZINE-2-CARBOXAMIDE
2.2 2 SME METHIONINE SULFOXIDE
2.2 2 SCH S-METHYL-THIO-CYSTEINE
2.2 2 PEG DI(HYDROXYETHYL)ETHER
2.2 2 OFH (4R)-4-[(2-CHLORO-4-{[(2S)-1,1,1-TRIFLUOROPROPAN-2-YL]OXY}PHENYL)SULFONYL]-N-{1-[(E)-IMINOMETHYL]CYCLOPROPYL}-1-{[1-(TRIFLUOROMETHYL)CYCLOPROPYL]CARBONYL}-L-PROLINAMIDE
2.2 2 NDG 2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE
2.2 2 H7J N-[(1S)-1-{1-[(1R,3E)-1-ACETYLPENT-3-EN-1-YL]-1H-1,2,3-TRIAZOL-4-YL}-1,2-DIMETHYLPROPYL]BENZAMIDE
2.2 2 FUC ALPHA-L-FUCOSE
2.2 2 33L N-(2-AMINOETHYL)-NALPHA-BENZOYL-L-PHENYLALANINAMIDE
2.2 2 2EV (3S,4S)-1-[(2-CHLOROPHENYL)SULFONYL]-N-[(2E)-2-IMINOETHYL]-4-(MORPHOLIN-4-YLCARBONYL)PYRROLIDINE-3-CARBOXAMIDE
2.2 2 1RV 2-{[(1H-1,2,4-TRIAZOL-5-YLSULFANYL)ACETYL]AMINO}THIOPHENE-3-CARBOXAMIDE
2.2 2 0IW NALPHA-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-N-[(3S)-1-PHENYL-5-(PHENYLSULFONYL)PENTAN-3-YL]-L-PHENYLALANINAMIDE
1.1 1 Z22 S-METHYL METHANESULFONOTHIOATE
1.1 1 YJ9 (2S,4R)-4-(2-CHLOROPHENYL)SULFONYL-N-[1-(IMINOMETHYL)CYCLOPROPYL]-1-[1-[4-(TRIFLUOROMETHYL)PHENYL]CYCLOPROPYL]CARBONYL-PYRROLIDINE-2-CARBOXAMIDE
1.1 1 YJ2 (2S,4R)-1-[1-(4-BROMOPHENYL)CYCLOPROPYL]CARBONYL-4-(2-CHLOROPHENYL)SULFONYL-N-[1-(IMINOMETHYL)CYCLOPROPYL]PYRROLIDINE-2-CARBOXAMIDE
1.1 1 VSC N-[N'-BENZYLOXYCARBONYL-PHENYLALANINYL]-3-AMINO-5-PHENYL-PENTANE-1-SULFONIC ACID PHENYL ESTER
1.1 1 VS4 3-[[N-[4-METHYL-PIPERAZINYL]CARBONYL]-PHENYLALANINYL-AMINO]-5-PHENYL-PENTANE-1-SULFONIC ACID BENZYLOXY-AMIDE
1.1 1 SDK 1,3-BIS[[N-[(PHENYLMETHOXY)CARBONYL]-L-LEUCYL]AMINO]-2-PROPANONE
1.1 1 QQV (1R,2R,4R)-N-(2-AZANYLIDENEETHYL)-2-MORPHOLIN-4-YLCARBONYL-4-(PHENYLSULFONYL)CYCLOPENTANE-1-CARBOXAMIDE
1.1 1 PO4 PHOSPHATE ION
1.1 1 PGO S-1,2-PROPANEDIOL
1.1 1 OCS CYSTEINESULFONIC ACID
1.1 1 O64 2-CHLORO-N-[(1S)-1-FORMYLPROPYL]-3-(TRIFLUOROMETHYL)BENZAMIDE
1.1 1 NSX N~2~,N~6~-BIS(BIPHENYL-4-YLACETYL)-L-LYSYL-D-ARGINYL-N-(2-PHENYLETHYL)-L-TYROSINAMIDE
1.1 1 MYP 4-MORPHOLIN-4-YL-PIPERIDINE-1-CARBOXYLIC ACID [1-(3-BENZENESULFONYL-1-PROPYL-ALLYLCARBAMOYL)-2-PHENYLETHYL]-AMIDE
1.1 1 MAN ALPHA-D-MANNOSE
1.1 1 K POTASSIUM ION
1.1 1 JG7 (2S,4R)-4-[2-CHLORANYL-4-(4-ETHYLPIPERAZIN-1-YL)PHENYL]SULFONYL-N-[1-(IMINOMETHYL)CYCLOPROPYL]-1-[1-(TRIFLUOROMETHYL)CYCLOPROPYL]CARBONYL-PYRROLIDINE-2-CARBOXAMIDE
1.1 1 ILI N-[(1S)-1-({[(3S,4S,7R)-3-HYDROXY-7-METHYL-1-(PYRIDIN-2-YLSULFONYL)-2,3,4,7-TETRAHYDRO-1H-AZEPIN-4-YL]AMINO}CARBONYL)-3-METHYLBUTYL]-1-BENZOFURAN-2-CARBOXAMIDE
1.1 1 I0X NALPHA-[(BENZYLOXY)CARBONYL]-N-[(1S)-1-(4-TERT-BUTOXYBENZYL)-3-DIAZO-2-OXOPROPYL]-L-PHENYLALANINAMIDE
1.1 1 HG MERCURY (II) ION
1.1 1 GNQ N-[(1R)-1-[(BENZYLSULFONYL)METHYL]-2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}-2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE
1.1 1 GNF N~2~-1,3-BENZOXAZOL-2-YL-3-CYCLOHEXYL-N-{2-[(4-METHOXYPHENYL)AMINO]ETHYL}-L-ALANINAMIDE
1.1 1 FSP [1-(4-FLUOROBENZYL)CYCLOBUTYL]METHYL (1S)-1-[OXO(1H-PYRAZOL-5-YLAMINO)ACETYL]PENTYLCARBAMATE
1.1 1 EOH ETHANOL
1.1 1 EF3 (E)-1-(1-METHYL-6-{4-[3-(4-METHYLPIPERAZIN-1-YL)PROPOXY]-3-(TRIFLUOROMETHYL)PHENYL}-1H-IMIDAZO[4,5-C]PYRIDIN-4-YL)METHANIMINE
1.1 1 DJT (2S,4R)-4-(2-CHLOROPHENYL)SULFONYL-1-[1-(4-FLUOROPHENYL)CYCLOPROPYL]CARBONYL-N-[1-(IMINOMETHYL)CYCLOPROPYL]PYRROLIDINE-2-CARBOXAMIDE
1.1 1 D1R NALPHA-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-N-{(1S)-3-PHENYL-1-[2-(PHENYLSULFONYL)ETHYL]PROPYL}-L-PHENYLALANINAMIDE
1.1 1 CT1 (1R)-2-METHYL-1-(PHENYLMETHYL)PROPYL[(1S)-1-FORMYLPENTYL]CARBAMATE
1.1 1 C1P N~2~-(MORPHOLIN-4-YLCARBONYL)-N-[(3S)-1-PHENYL-5-(PHENYLSULFONYL)PENTAN-3-YL]-L-LEUCINAMIDE
1.1 1 BR BROMIDE ION
1.1 1 BME BETA-MERCAPTOETHANOL
1.1 1 BD3 NALPHA-[(3-TERT-BUTYL-1-METHYL-1H-PYRAZOL-5-YL)CARBONYL]-N-[(2E)-2-IMINOETHYL]-3-{5-[(Z)-IMINOMETHYL]-1,3,4-OXADIAZOL-2-YL}-L-PHENYLALANINAMIDE
1.1 1 B95 N-[2-(1H-BENZIMIDAZOL-2-YL)ETHYL]-2-(2-BROMOPHENOXY)ACETAMIDE
1.1 1 93N 6-{4-[3-(4-METHYLPIPERAZIN-1-YL)PROPOXY]-3-(TRIFLUOROMETHYL)PHENYL}PYRIDINE-2-CARBONITRILE
1.1 1 935 (E)-1-(6-{4-[3-(4-METHYLPIPERAZIN-1-YL)PROPOXY]-3-(TRIFLUOROMETHYL)PHENYL}PYRIDIN-2-YL)METHANIMINE
1.1 1 750 5-(2-MORPHOLIN-4-YLETHOXY)BENZOFURAN-2-CARBOXYLIC ACID ((S)-3-METHYL-1-{(S)-3-OXO-1-[2-(3-PYRIDIN-2-YLPHENYL)ACETYL]AZEPAN-4-YLCARBAMOYL}BUTYL)AMIDE
1.1 1 6HM [([1,1'-biphenyl]-2-yl)methyl]propanedioic acid
1.1 1 5T9 (2~{S},4~{R})-4-[(2-chloranyl-4-methoxy-phenyl)-bis(oxidanyl)-$l^{4}-sulfanyl]-1-[3-(5-chloranylpyridin-2-yl)azetidin-3-yl]carbonyl-~{N}-[1-(iminomethyl)cyclopropyl]pyrrolidine-2-carboxamide
1.1 1 4MC (Z)-N-(5-GUANIDINO-1-OXO-1-(5-PHENYL-1-(PHENYLSULFONYL)PENT-1-EN-3-YLAMINO)PENTAN-2-YL)-4-METHYLPIPERAZINE-1-CARBOXAMIDE
1.1 1 3Y2 2-amino-4-chloro-N-(1-{[(2E)-2-iminoethyl]carbamoyl}cyclohexyl)benzamide
1.1 1 2V5 N-[(2S)-5-(carbamimidamidooxy)-1-oxo-1-{[(1E,3S)-5-phenyl-1-(phenylsulfonyl)pent-1-en-3-yl]amino}pentan-2-yl]-4-methylpiperazine-1-carboxamide
1.1 1 0LC (1R,2R)-N-(1-CYANOCYCLOPROPYL)-2-[(8-FLUORO-1,3,4,5-TETRAHYDRO-2H-PYRIDO[4,3-B]INDOL-2-YL)CARBONYL]CYCLOHEXANECARBOXAMIDE
# -------------------------------------------------------------------
# Notes: %Freq gives (as a percentage) the number of usages
# of the concept in which the associated Chemical Compund or
# Ligand was observed in the HETATM record.
# -------------------------------------------------------------c_0185