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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02399280

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TESTESTOSTERONEA1JTV0.77
TESTESTOSTERONEA2Q7L0.77
TESTESTOSTERONEA2Q7I0.77
TESTESTOSTERONEA,B1J960.77
TESTESTOSTERONEA2Q7K0.77
TESTESTOSTERONEA,B1Q130.77
TESTESTOSTERONEH1I9J0.77
TESTESTOSTERONEA,B1AFS0.77
TESTESTOSTERONEH1VPO0.77
TESTESTOSTERONEA2Q7J0.77
TESTESTOSTERONEA,B3BUR0.77
TESTESTOSTERONEA2AM90.77
STRPROGESTERONEA1H600.91
STRPROGESTERONEA,B,C1YA30.91
STRPROGESTERONEA,B2AA60.91
STRPROGESTERONEA1MRQ0.91
STRPROGESTERONEA,B1A280.91
STRPROGESTERONEA,B2AA50.91
STRPROGESTERONEA2HZQ0.91
STRPROGESTERONEA1W0F0.91
STRPROGESTERONEA2ABA0.91
STRPROGESTERONEA,B3COT0.91
STRPROGESTERONEH1DBB0.91
STRPROGESTERONEH,L2O5Y0.91
DL4(14beta,17alpha,25R)-3-oxocholest-
4-en-26-oic acid
A3GYT0.78
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,B1BUQ0.7
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.73
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE
A1Q200.72
1CADESOXYCORTICOSTERONEA,B1Y9R0.76
1CADESOXYCORTICOSTERONEA,B,C2ABI0.76
1CADESOXYCORTICOSTERONEA2Q3Y0.76
1CADESOXYCORTICOSTERONEA2AA70.76
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.89
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid
A3GYU0.74
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.77
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.77
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.77
C0RCORTICOSTERONEA2A3I0.73
C0RCORTICOSTERONEA,B1Y5R0.73
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A,B2VDY0.7
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A2V950.7
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.91
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.91
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.91
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.91
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.91
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.91
ASD4-ANDROSTENE-3-17-DIONEA1XF00.91
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B1SQN0.76
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B2W8Y0.76
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A1LHV0.76
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A,B3D900.76