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


and

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





INPUT WORD = C00000112 , 50% or more
[ Metabolite Name : Indole-3-carboxaldehyde , Indole-3-carboxyaldehyde , 1H-Indole-3-carboxaldehyde ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00041598 Indole-3-methanol
Indole-3-carbinol
95.65
C00044432 2-Quinolone 91.30
C00000109 Indole-3-acetaldehyde 88.00
C00000113 Indole-3-carboxylic acid 88.00
C00000114 Indole-3-ethanol
Tryptophol
88.00
C00002154 Echinopsine 88.00
C00023598 4-(Hydroxymethyl)-2-methylindole 88.00
C00026388 4-Hydroxyquinolin-2(1H)-one
2,4-Dihydroxyquinoline
DHQ
88.00
C00026451 Jineol 88.00
C00026885 CID is old! 88.00
C00041284 5-Hydroxyindole-3-carbaldehyde 88.00
C00001430 Skatole 86.96
C00023597 2,4-Dimethylindole 86.96
C00026478 Quinoline 86.96
C00026981 Isatin 86.96
C00042152 5-Formylbenzofuran 86.96
C00048293 5-Hydroxyoxindole 86.96
C00027108 Brassilexin 84.62
C00000107 Indole-3-acetonitrile
IAN
84.00
C00001434 Tryptamine
beta-(3-Indolyl)ethylamine
1H-Indole-3-ethanamine
84.00
C00019143 3-Hydroxycoumarin
3-Coumarinol
84.00
C00044485 7-Hydroxychromone 84.00
C00018586 WF 5239 83.33
C00000157 4-Phenylbutan-2-one 82.61
C00001405 Cathine
D-Cathine
82.61
C00001406 D-Cathinone 82.61
C00001418 Indole 82.61
C00002460 Coumarin 82.61
C00011012 4-Isopropyl-2,4,6-cycloheptatrien-1-one
Nezukone
82.61
C00026882 3,6-Dibromoindole 82.61
C00044952 N-Butylbenzenamine 82.61
C00049061 1,2-Dihydroisoquinoline 82.61
C00000100 Indole-3-acetic acid
Indoleacetic acid
IAA
Indole-3-acetate
81.48
C00000108 Indole-3-acetamide
1H-Indole-3-acetamide
IAM
81.48
C00002155 Echinorine 81.48
C00007577 1-Methoxyindole-3-carbaldehyde 81.48
C00007578 4-Methoxyindole-3-carbaldehyde 81.48
C00007579 Indole 3-carboxylic acid methyl ester 81.48
C00023599 4-Methoxymethyl-2-methylindole 81.48
C00026586 Isalexin 81.48
C00027107 Brassicanal A 81.48
C00029578 6-Methoxyindoline-2,3-dione 81.48
C00030756 Methyl indole-3-carboxylate 81.48
C00041264 3-(Hydroxyacetyl)indole 81.48
C00045185 5-Hydroxy-3-(2-hydroxyethyl)-indole 81.48
C00018703 Tuberine
Tuberin
80.77
C00029577 6-Methoxy-2H-1-benzopyran
6-Methoxybenzopyran
80.00
C00043174 2-Methyl-3H-quinazolin-4-one 80.00
C00045576 5-Hydroxycoumarin 80.00
C00000751 Phenylpyruvic acid 79.17
C00001354 L-2,5-Dihydrophenylalanine 79.17
C00001386 L-Phenylalanine
L-Phe
79.17
C00001409 L-Ephedrine
Ephedrine
1(R),2(S)-erythro-(-)-Ephedrine
(-)-Ephedrine
79.17
C00003062 beta-Thujaplicin 79.17
C00035454 1,3,5-Trimethoxybenzene 79.17
C00042126 3-Hydroxy-4-methoxyphenethylamine
p-Methoxydopamine
79.17
C00042132 3-Methoxytyramine 79.17
C00042859 p-Methoxyamphetamine 79.17
C00046823 Methyl-beta-orcinol carboxylate 79.17
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