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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01795660

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OBNOUABAINH,L1IBG0.88
DGXDIGOXINB,D1IGJ0.85
SXNSalinixanthinA,B3DDL0.81
FUAFUSIDIC ACIDA1QCA0.8
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.8
FUAFUSIDIC ACIDA,B2VUF0.8
MRCMUPIROCINA1JZS0.79
MRCMUPIROCINA,T1FFY0.79
MRCMUPIROCINA1QU30.79
MRCMUPIROCINA,T1QU20.79
GR4H,I1AWF0.79
FSCFUSICOCCINA1O9E0.78
FSCFUSICOCCINA,P1O9F0.78
FSCFUSICOCCINA,B2O980.78
DOGDIGOXIGENINA1LKE0.78
CXTCARBOXYATRACTYLOSIDEA2C3E0.77
CXTCARBOXYATRACTYLOSIDEA1OKC0.77
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
3G710.77
DTXDIGITOXIGENINA1LNM0.77
SRNSORANGICIN AC,D1YNJ0.77
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.76
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.76
GMMGLUCOSE MONOMYCOLATEA1UQS0.76
FOKFORSKOLINA,C3C160.75
FOKFORSKOLINA,C1CJU0.75
FOKFORSKOLINA,C1TL70.75
FOKFORSKOLINA,B1AB80.75
FOKFORSKOLINA,C3C140.75
FOKFORSKOLINA,C1CJT0.75
FOKFORSKOLINA,B,C1CUL0.75
FOKFORSKOLINA,C1CJV0.75
FOKFORSKOLINA,C3C150.75
FOKFORSKOLINA,C1U0H0.75
FOKFORSKOLINA,B,C1CS40.75
FOKFORSKOLINA,C1CJK0.75
OKAOKADAIC ACIDA1JK70.75
OKAOKADAIC ACIDC2IE40.75
OKAOKADAIC ACIDA1U320.75
PULA2C780.75
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.73
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.73
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.73
0ASasiatic acidA2QN10.73
MOUA,B2NPF0.73
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
E7BA,B3E7B0.73
PRB13-ACETYLPHORBOLA1PTR0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER
H,L,M2J8C0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER
L,M1M3X0.73
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.72
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,B1BUQ0.72
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.72
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.72
CW1Cotylenin AA,B,C,D3E6Y0.72
PIDPERIDININA2C9E0.72
PIDPERIDININM,N,O1PPR0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
A,D1R1K0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,U1Z5X0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,F,G,H2NXX0.72
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.71
FUGFUMAGILLINA,B3FMQ0.71
FUGFUMAGILLINA1BOA0.71
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID
H,L2E270.71
CBOCARBENOXOLONEA,B,C,D1HDC0.71
CBOCARBENOXOLONEA,B,C,D2BEL0.71
SCGMETHYL (2S,3R,4S)-2-(BETA-D-GLUCOPYRANOSYLOXY)-
4-(2-OXOETHYL)-3-VINYL-3,4-DIHYDRO-
2H-PYRAN-5-CARBOXYLATE
A,B2FPC0.71
0MAmaslinic acidA2QN20.7
RGCREIDISPONGIOLIDE CA2ASP0.7
AURAUROVERTIN BA,B,C,D,E,F1COW0.7
SODA2E1R0.7