Top chemical compounds for concept: c_0801
# Observed top chemical compounds associated with the concept c_0801
# mined from the 'HETATM' record lines within the wwPDB
# coordinate files of this concept's usages.
# -------------------------------------------------------------c_0801
# %Freq Ligand/Chemical Compound
# -------------------------------------------------------------------
45.5 70 NAD NICOTINAMIDE-ADENINE-DINUCLEOTIDE
42.9 66 MG MAGNESIUM ION
32.5 50 ADP ADENOSINE-5'-DIPHOSPHATE
8.4 13 CL CHLORIDE ION
5.8 9 GTP GUANOSINE-5'-TRIPHOSPHATE
5.2 8 SO4 SULFATE ION
5.2 8 GDP GUANOSINE-5'-DIPHOSPHATE
4.5 7 ANP PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
3.2 5 UNX UNKNOWN ATOM OR ION
3.2 5 TCU 5-HEXYL-2-(2-METHYLPHENOXY)PHENOL
3.2 5 TA1 TAXOL
3.2 5 NA SODIUM ION
3.2 5 MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID
3.2 5 EDO 1,2-ETHANEDIOL
3.2 5 2NV 3,6,9,12,15-pentaoxaoctadecan-17-amine
3.2 5 1S5 5-(4-amino-2-methylphenoxy)-2-hexyl-4-hydroxy-1-methylpyridinium
2.6 4 PYW PYRIDOMYCIN
2.6 4 PO4 PHOSPHATE ION
2.6 4 NO3 NITRATE ION
2.6 4 JDD N-[2-(METHYLAMINO)-2-OXIDANYLIDENE-ETHYL]-2-(4-PYRAZOL-1-YLPHENYL)-N-(1-PYRIDIN-2-YLPIPERIDIN-4-YL)ETHANAMIDE
2.6 4 I4I 3-HYDROXY-N-[(2R,5R,6S,9S,10S,11R)-10-HYDROXY-5,11-DIMETHYL-3,7,12-TRIOXO-2-(PROPAN-2-YL)-9-(PYRIDIN-3-YLMETHYL)-1,4-DIOXA-8-AZACYCLODODECAN-6-YL]PYRIDINE-2-CARBOXAMIDE
2.6 4 G7X ISPINESIB MESILATE
2.6 4 EEH N-[4-[2-[(2S)-4-[2-(METHYLAMINO)-2-OXIDANYLIDENE-ETHYL]-3-OXIDANYLIDENE-2-(PHENYLMETHYL)PIPERAZIN-1-YL]-2-OXIDANYLIDENE-ETHYL]CYCLOHEXYL]-2-(3-METHYL-1-BENZOTHIOPHEN-2-YL)ETHANAMIDE
2.6 4 9NU (2S,4S)-N-METHYL-4-[[(2S,3R)-3-[(2-METHYLPROPAN-2-YL)OXY]-2-[[4-(PYRAZOL-1-YLMETHYL)PHENYL]CARBONYLAMINO]BUTANOYL]AMINO]-1-(PHENYLCARBONYL)PYRROLIDINE-2-CARBOXAMIDE
2.6 4 9CV 5-[(4-FLUORANYL-3-PHENOXY-PHENYL)METHYLAMINO]-~{N}-METHYL-6-[(1-PYRIDIN-2-YLPIPERIDIN-4-YL)AMINO]PYRIDINE-3-CARBOXAMIDE
1.9 3 ZN ZINC ION
1.9 3 VMY (1S)-1-(5-{[1-(2,6-DIFLUOROBENZYL)-1H-PYRAZOL-3-YL]AMINO}-1,3,4-THIADIAZOL-2-YL)-1-(4-METHYL-1,3-THIAZOL-2-YL)ETHANOL
1.9 3 S72 1-BENZYL-N-[CIS-4-(2-{[(4-FLUOROPHENYL)METHYL][2-(METHYLAMINO)-2-OXOETHYL]AMINO}-2-OXOETHYL)CYCLOHEXYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE
1.9 3 KXU 5-{[(4,6-DIMETHYLPYRIMIDIN-2-YL)SULFANYL]METHYL}-N-[(2-METHYLPYRIDIN-4-YL)METHYL]-1,2-OXAZOLE-3-CARBOXAMIDE
1.9 3 GOL GLYCEROL
1.9 3 EPE 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
1.9 3 DQ8 1-(3-{[(2-AMINOETHYL)SULFANYL](DIPHENYL)METHYL}PHENYL)ETHANONE
1.9 3 DMS DIMETHYL SULFOXIDE
1.9 3 ACT ACETATE ION
1.9 3 9G4 1-{4-[(ACETYLAMINO)METHYL]PHENYL}-4-(4-CHLOROPHENOXY)-6-OXO-1,6-DIHYDROPYRIDAZINE-3-CARBOXAMIDE
1.9 3 8PC 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN-2-YLMETHYL)PHENOL
1.9 3 6KA N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-5-[(1S)-1-(3-methyl-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
1.3 2 UUD N-(1,3-BENZOTHIAZOL-2-YL)ACETAMIDE
1.3 2 TRS 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
1.3 2 TCL TRICLOSAN
1.3 2 PIN PIPERAZINE-N,N'-BIS(2-ETHANESULFONIC ACID)
1.3 2 PEG DI(HYDROXYETHYL)ETHER
1.3 2 P1H {(2R,3S,4R,5R)-5-[(4S)-3-(AMINOCARBONYL)-4-(2-PROPYLISONICOTINOYL)PYRIDIN-1(4H)-YL]-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL}METHYL [(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE
1.3 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL
1.3 2 KV1 N-((3R,5S)-1-(BENZOFURAN-3-CARBONYL)-5-(ETHYLCARBAMOYL)PYRROLIDIN-3-YL)-3-ETHYL-1-METHYL-1H-PYRAZOLE-5-CARBOXAMIDE
1.3 2 ACP PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER
1.3 2 5PP 5-PENTYL-2-PHENOXYPHENOL
1.3 2 2XA (2R)-2-AMINO-3-[(4-CHLOROPHENYL)-DIPHENYL-METHYL]SULFANYL-PROPANOIC ACID
1.3 2 1US 2-(2-chloranylphenoxy)-5-hexyl-phenol
1.3 2 1TN 5-hexyl-2-(2-nitrophenoxy)phenol
# -------------------------------------------------------------------
# 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_0801