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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02392548

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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,B1BUQ0.74
DEXDEXAMETHASONEA,D1M2Z0.82
DEXDEXAMETHASONEA,B,C,D1P930.82
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.73
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.73
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.73
AS4ALDOSTERONEA2AA20.75
AS4ALDOSTERONEA2Q1H0.75
MOUA,B2NPF0.72
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one		A,D2R400.75
FOKFORSKOLINA,C3C160.7
FOKFORSKOLINA,C1CJU0.7
FOKFORSKOLINA,C1TL70.7
FOKFORSKOLINA,B1AB80.7
FOKFORSKOLINA,C3C140.7
FOKFORSKOLINA,C1CJT0.7
FOKFORSKOLINA,B,C1CUL0.7
FOKFORSKOLINA,C1CJV0.7
FOKFORSKOLINA,C3C150.7
FOKFORSKOLINA,C1U0H0.7
FOKFORSKOLINA,B,C1CS40.7
FOKFORSKOLINA,C1CJK0.7
GA4GIBBERELLIN A4A2ZSI0.72
GA4GIBBERELLIN A4A,B,C,D,E,F3EBL0.72
GA4GIBBERELLIN A4H,I1KFA0.72
ZK59ALPHA-FLUOROCORTISOLA1GS40.8
GA3GIBBERELLIN A3A2ZSH0.72
GA3GIBBERELLIN A3A,B,C,D,E,F3ED10.72
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,D1AWH0.73
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		3G710.75
1CADESOXYCORTICOSTERONEA,B1Y9R0.74
1CADESOXYCORTICOSTERONEA,B,C2ABI0.74
1CADESOXYCORTICOSTERONEA2Q3Y0.74
1CADESOXYCORTICOSTERONEA2AA70.74
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione		A,B2VDY0.79
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione		A2V950.79
TESTESTOSTERONEA1JTV0.73
TESTESTOSTERONEA2Q7L0.73
TESTESTOSTERONEA2Q7I0.73
TESTESTOSTERONEA,B1J960.73
TESTESTOSTERONEA2Q7K0.73
TESTESTOSTERONEA,B1Q130.73
TESTESTOSTERONEH1I9J0.73
TESTESTOSTERONEA,B1AFS0.73
TESTESTOSTERONEH1VPO0.73
TESTESTOSTERONEA2Q7J0.73
TESTESTOSTERONEA,B3BUR0.73
TESTESTOSTERONEA2AM90.73
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
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A3EAU0.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A3EB30.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A3EB40.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A,B2AAX0.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A1H610.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A,B3CMF0.74
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE		A2Q1V0.74
GR4H,I1AWF0.76
C0RCORTICOSTERONEA2A3I0.77
C0RCORTICOSTERONEA,B1Y5R0.77
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPG0.73
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPJ0.73
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPF0.73
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.75