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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00462022

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0ASasiatic acidA2QN10.75
CBOCARBENOXOLONEA,B,C,D1HDC0.85
CBOCARBENOXOLONEA,B,C,D2BEL0.85
AS4ALDOSTERONEA2AA20.84
AS4ALDOSTERONEA2Q1H0.84
DOGDIGOXIGENINA1LKE0.71
CA4CYPROTERONE ACETATEA2OZ70.72
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
DEXDEXAMETHASONEA,D1M2Z0.79
DEXDEXAMETHASONEA,B,C,D1P930.79
0MAmaslinic acidA2QN20.73
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.8
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.82
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.82
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.82
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.75
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.75
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.75
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.75
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.75
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.75
ASD4-ANDROSTENE-3-17-DIONEA1XF00.75
CLLCHOLESTERYL LINOLEATEA,B1CLE0.85
C0RCORTICOSTERONEA2A3I0.84
C0RCORTICOSTERONEA,B1Y5R0.84
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.8
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.74
DTXDIGITOXIGENINA1LNM0.72
1CADESOXYCORTICOSTERONEA,B1Y9R0.79
1CADESOXYCORTICOSTERONEA,B,C2ABI0.79
1CADESOXYCORTICOSTERONEA2Q3Y0.79
1CADESOXYCORTICOSTERONEA2AA70.79
803LOVASTATINA,B1CQP0.71
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.78
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.78
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.78
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.78
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.78
2OBCHOLESTERYL OLEATEA2OBD0.85