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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02218673

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.9
1CADESOXYCORTICOSTERONEA,B1Y9R0.77
1CADESOXYCORTICOSTERONEA,B,C2ABI0.77
1CADESOXYCORTICOSTERONEA2Q3Y0.77
1CADESOXYCORTICOSTERONEA2AA70.77
TESTESTOSTERONEA1JTV0.78
TESTESTOSTERONEA2Q7L0.78
TESTESTOSTERONEA2Q7I0.78
TESTESTOSTERONEA,B1J960.78
TESTESTOSTERONEA2Q7K0.78
TESTESTOSTERONEA,B1Q130.78
TESTESTOSTERONEH1I9J0.78
TESTESTOSTERONEA,B1AFS0.78
TESTESTOSTERONEH1VPO0.78
TESTESTOSTERONEA2Q7J0.78
TESTESTOSTERONEA,B3BUR0.78
TESTESTOSTERONEA2AM90.78
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A1LHV0.77
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A,B3D900.77
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B1SQN0.77
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B2W8Y0.77
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
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1E3G0.8
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A,B1E3K0.8
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A2AO60.8
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1XOW0.8
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1XQ30.8
STRPROGESTERONEA1H600.93
STRPROGESTERONEA,B,C1YA30.93
STRPROGESTERONEA,B2AA60.93
STRPROGESTERONEA1MRQ0.93
STRPROGESTERONEA,B1A280.93
STRPROGESTERONEA,B2AA50.93
STRPROGESTERONEA2HZQ0.93
STRPROGESTERONEA1W0F0.93
STRPROGESTERONEA2ABA0.93
STRPROGESTERONEA,B3COT0.93
STRPROGESTERONEH1DBB0.93
STRPROGESTERONEH,L2O5Y0.93
CA4CYPROTERONE ACETATEA2OZ70.71
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.78
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.78
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.78
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.75
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.75
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.75
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.75
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.75
2OBCHOLESTERYL OLEATEA2OBD0.7
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.93
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.93
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.93
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.93
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.93
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.93
ASD4-ANDROSTENE-3-17-DIONEA1XF00.93
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE
A2AMB0.8
C0RCORTICOSTERONEA2A3I0.73
C0RCORTICOSTERONEA,B1Y5R0.73
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE
A1Q200.74
CLLCHOLESTERYL LINOLEATEA,B1CLE0.7
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
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid
A3GYU0.77