"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more




INPUT WORD = C00001509 , 50% or more
[ Metabolite Name : Theobromine ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00032640 3,7-Dimethylguanine 96.30
C00039930 Paraxanthine 96.30
C00001492 Caffeine
Caffein		 93.10
C00001510 Theophylline 92.59
C00007326 7-Methylxanthine 92.59
C00043196 3-Methylxanthine 92.59
C00043142 1,3-Dimethylisoguanine 88.89
C00049062 1,3-Dimethylguanine 88.89
C00007301 Urate
Uric acid		 85.19
C00018651 7-Hydroxyguanine 85.19
C00019660 Xanthine 85.19
C00001399 Willardiine 82.14
C00034312 Theacrine 81.82
C00001501 Guanine 81.48
C00032053 N,N-Dimethyladenine 81.48
C00023610 N-Formylloline 78.57
C00001502 Hypoxanthine 77.78
C00007531 5-Hydroxyisourate 77.78
C00043227 8-Oxoadenine 77.78
C00050364 Heteromine E 76.67
C00050367 Heteromine H 76.67
C00001375 Isowillardiine 75.00
C00023615 N-Acetylnorloline 75.00
C00050366 Heteromine G 75.00
C00001490 Adenine 74.07
C00001977 Gentianine 74.07
C00010641 trans-1,2,trans-1,5-2-(1-Formylethyl)-5-methyl-cyclopentanecarboxylic acidNepetalic acid 74.07
C00016393 Hydroxyakalone 74.07
C00017767 Antibiotic YN 0165J-A 74.07
C00018697 8-Azaguanine
Azaguanine
Azan
Guanazol
Guanazolo
NSC 151069
NSC 223526
NSC 749
Pathocidin
Pathocidine		 74.07
C00018766 VD 844 74.07
C00018807 6-Mercaptoguanine
6-Thioguanine
NSC 752
NSC 76504
Tabloid
Thioguanine
Tioguanin
Tioguanine		 74.07
C00023612 N-Methylloline
NML		 74.07
C00023614 N-Formylnorloline 74.07
C00025366 4beta-Hydroxyepilupinine 74.07
C00026244 Glycosmicine
1,2,3,4-Tetrahydro-1-methyl-2,4-dioxoquinazoline
1-Methyl-2,4(1H,3H)-quinazolinedione
1-Methyl-2,4-quinazolinedione		 74.07
C00027844 Aminozooanemonin 74.07
C00028072 Clavulazine 74.07
C00028779 Ovothiol A
L-Ovothiol A		 74.07
C00029032 Solsodomine B 74.07
C00031464 (4R)-4-Hydroxymethylboschnialactone 74.07
C00023611 N-Acetylloline
NAL		 73.33
C00030143 CID is old! 72.97
C00029584 7,9-Dihydro-1-(3-oxobutyl)-1H-purine-6,8-dione 72.73
C00041466 cyclo(L-Pro-L-Val) 72.41
C00007532 2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazole
OHCU		 71.43
C00010435 1,6-Dibromo-2-chloro-3(8)-ochtoden-4-ol
5-Bromo-2-(2-bromo-1-chloroethl)-4,4-dimethyl-2-cyclohexen-1-ol		 71.43
C00010803 Adriadysiolide 71.43
C00010997 (-)-Palasonin 71.43
C00014977 8-Chloro-9-hydroxy-8,9-deoxyasperlactone 71.43
C00028811 Pedatisectine D 71.43
C00046934 Streptazone A
(+)-Streptazone A		 71.43
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