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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03333580

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LVA(3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6-
DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}-
1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN-
1-YL)-3,5-DIHYDROXYHEPTANOIC ACID
A,B1T020.73
114COMPACTINA,B,C,D1HW80.73
SIMSIMVASTATINA,B,C,D1HW90.75
803LOVASTATINA,B1CQP0.75
0MAmaslinic acidA2QN20.75
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,B1BUQ0.72
CBOCARBENOXOLONEA,B,C,D1HDC0.72
CBOCARBENOXOLONEA,B,C,D2BEL0.72
2OBCHOLESTERYL OLEATEA2OBD0.77
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.72
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.7
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.7
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.7
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.7
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.7
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.71
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.71
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.71
MVB(1S,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO-
7-METHYL-8-[2-[(2R,4R)-TETRAHYDRO-
4-HY DROXY-6-OXO-2H-PYRAN-2-YL]ETHYL]-
1-NAPHTHALENOL
A,B,C1YA80.76
CLLCHOLESTERYL LINOLEATEA,B1CLE0.77