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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03404858

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
114COMPACTINA,B,C,D1HW80.73
803LOVASTATINA,B1CQP0.75
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.73
C0RCORTICOSTERONEA2A3I0.8
C0RCORTICOSTERONEA,B1Y5R0.8
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA1S0X0.78
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA2Q9F0.78
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA,B,C2HKA0.78
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE
A2AMB0.72
CBOCARBENOXOLONEA,B,C,D1HDC0.77
CBOCARBENOXOLONEA,B,C,D2BEL0.77
CLRCHOLESTEROLA,B2ZXE0.77
CLRCHOLESTEROLA1N830.77
CLRCHOLESTEROLA2RH10.77
CLRCHOLESTEROLA1LRI0.77
CLRCHOLESTEROLA1ZHY0.77
CLRCHOLESTEROLA3D4S0.77
CA4CYPROTERONE ACETATEA2OZ70.74
0ASasiatic acidA2QN10.77
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
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.78
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.73
0MAmaslinic acidA2QN20.79
CO117-[3-(3,3-DIMETHYL-OXIRANYL)-1-
METHYL-PROPYL]-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17-
TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-
3-OL
A,B1P8D0.77
2OBCHOLESTERYL OLEATEA2OBD0.95
1CADESOXYCORTICOSTERONEA,B1Y9R0.79
1CADESOXYCORTICOSTERONEA,B,C2ABI0.79
1CADESOXYCORTICOSTERONEA2Q3Y0.79
1CADESOXYCORTICOSTERONEA2AA70.79
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.86
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.86
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.86
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.86
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.86
AS4ALDOSTERONEA2AA20.76
AS4ALDOSTERONEA2Q1H0.76
CLLCHOLESTERYL LINOLEATEA,B1CLE0.95