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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02382490

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1CADESOXYCORTICOSTERONEA,B1Y9R0.86
1CADESOXYCORTICOSTERONEA,B,C2ABI0.86
1CADESOXYCORTICOSTERONEA2Q3Y0.86
1CADESOXYCORTICOSTERONEA2AA70.86
C0RCORTICOSTERONEA2A3I0.82
C0RCORTICOSTERONEA,B1Y5R0.82
0ASasiatic acidA2QN10.73
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.88
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.88
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.88
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.83
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.83
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.83
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.83
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.83
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA1S0X0.7
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA2Q9F0.7
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA,B,C2HKA0.7
0MAmaslinic acidA2QN20.73
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.88
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.88
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.88
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.88
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.88
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.88
ASD4-ANDROSTENE-3-17-DIONEA1XF00.88
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.8
FUAFUSIDIC ACIDA1QCA0.73
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.73
FUAFUSIDIC ACIDA,B2VUF0.73
DEXDEXAMETHASONEA,D1M2Z0.76
DEXDEXAMETHASONEA,B,C,D1P930.76
CA4CYPROTERONE ACETATEA2OZ70.76
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.85
CLLCHOLESTERYL LINOLEATEA,B1CLE0.84
CLRCHOLESTEROLA,B2ZXE0.71
CLRCHOLESTEROLA1N830.71
CLRCHOLESTEROLA2RH10.71
CLRCHOLESTEROLA1LRI0.71
CLRCHOLESTEROLA1ZHY0.71
CLRCHOLESTEROLA3D4S0.71
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE
A2AMB0.79
CBOCARBENOXOLONEA,B,C,D1HDC0.76
CBOCARBENOXOLONEA,B,C,D2BEL0.76
2OBCHOLESTERYL OLEATEA2OBD0.84
AS4ALDOSTERONEA2AA20.79
AS4ALDOSTERONEA2Q1H0.79