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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03863251

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GR33-ACETOXY-17-(1-FORMYL-5-METHYL-
3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14-
TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17-
TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE-
4-CARBOXYLIC ACID
B,D1AWH0.78
MRCMUPIROCINA1JZS0.71
MRCMUPIROCINA,T1FFY0.71
MRCMUPIROCINA1QU30.71
MRCMUPIROCINA,T1QU20.71
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.71
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.71
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.71
LVA(3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6-
DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}-
1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN-
1-YL)-3,5-DIHYDROXYHEPTANOIC ACID
A,B1T020.73
RGCREIDISPONGIOLIDE CA2ASP0.73
114COMPACTINA,B,C,D1HW80.73
WINmethyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)-
15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}-
3,11,12-trihydroxy-2,16-dioxo-13,20-
epoxypicras-3-en-21-oate
0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
3G710.78
SIMSIMVASTATINA,B,C,D1HW90.75
NTHSUCCINIC ACID MONO-(13-METHYL-3-
OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17-
TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-
17-YL) ESTER
A,B1BUQ0.73
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.76
DOGDIGOXIGENINA1LKE0.87
GA4GIBBERELLIN A4A2ZSI0.73
GA4GIBBERELLIN A4A,B,C,D,E,F3EBL0.73
GA4GIBBERELLIN A4H,I1KFA0.73
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.74
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.74
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.74
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.75
GR4H,I1AWF0.72
DGXDIGOXINB,D1IGJ0.75
TG1A,B2AGV0.73
TG1A2ZBF0.73
TG1A2ZBG0.73
TG1A,B,C,D1WPG0.73
TG1A2C8L0.73
TG1A2EAR0.73
TG1A,B1IWO0.73
TG1A2C880.73
TG1A2DQS0.73
TG1A2C8K0.73
TG1A1XP50.73
TG1A2EAT0.73
PRB13-ACETYLPHORBOLA1PTR0.71
GA3GIBBERELLIN A3A2ZSH0.78
GA3GIBBERELLIN A3A,B,C,D,E,F3ED10.78
MVB(1S,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO-
7-METHYL-8-[2-[(2R,4R)-TETRAHYDRO-
4-HY DROXY-6-OXO-2H-PYRAN-2-YL]ETHYL]-
1-NAPHTHALENOL
A,B,C1YA80.7
DEXDEXAMETHASONEA,D1M2Z0.71
DEXDEXAMETHASONEA,B,C,D1P930.71
FUAFUSIDIC ACIDA1QCA0.85
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.85
FUAFUSIDIC ACIDA,B2VUF0.85
CBOCARBENOXOLONEA,B,C,D1HDC0.72
CBOCARBENOXOLONEA,B,C,D2BEL0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
A,D1R1K0.75
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,U1Z5X0.75
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,F,G,H2NXX0.75
DTXDIGITOXIGENINA1LNM0.86
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A,B2VDY0.73
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A2V950.73
OBNOUABAINH,L1IBG0.77
ZK59ALPHA-FLUOROCORTISOLA1GS40.72
PIDPERIDININA2C9E0.72
PIDPERIDININM,N,O1PPR0.72
TESTESTOSTERONEA1JTV0.71
TESTESTOSTERONEA2Q7L0.71
TESTESTOSTERONEA2Q7I0.71
TESTESTOSTERONEA,B1J960.71
TESTESTOSTERONEA2Q7K0.71
TESTESTOSTERONEA,B1Q130.71
TESTESTOSTERONEH1I9J0.71
TESTESTOSTERONEA,B1AFS0.71
TESTESTOSTERONEH1VPO0.71
TESTESTOSTERONEA2Q7J0.71
TESTESTOSTERONEA,B3BUR0.71
TESTESTOSTERONEA2AM90.71
0ASasiatic acidA2QN10.71
FOKFORSKOLINA,C3C160.76
FOKFORSKOLINA,C1CJU0.76
FOKFORSKOLINA,C1TL70.76
FOKFORSKOLINA,B1AB80.76
FOKFORSKOLINA,C3C140.76
FOKFORSKOLINA,C1CJT0.76
FOKFORSKOLINA,B,C1CUL0.76
FOKFORSKOLINA,C1CJV0.76
FOKFORSKOLINA,C3C150.76
FOKFORSKOLINA,C1U0H0.76
FOKFORSKOLINA,B,C1CS40.76
FOKFORSKOLINA,C1CJK0.76
C0RCORTICOSTERONEA2A3I0.72
C0RCORTICOSTERONEA,B1Y5R0.72
803LOVASTATINA,B1CQP0.71
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.74