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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02429963

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HC220-HYDROXYCHOLESTEROLA1ZHW0.76
GR33-ACETOXY-17-(1-FORMYL-5-METHYL-
3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14-
TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17-
TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE-
4-CARBOXYLIC ACID
B,D1AWH0.7
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,B1BUQ0.74
DTXDIGITOXIGENINA1LNM0.71
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,B1P8D0.76
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.75
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.75
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.75
HC325-HYDROXYCHOLESTEROLA1ZHX0.76
VDB(1R,2S,3R,5Z,7E)-17-{(1R)-1-[(2-
ethyl-2-hydroxybutyl)sulfanyl]ethyl}-
2-(2-hydroxyethoxy)-9,10-secoestra-
5,7,16-triene-1,3-diol
A2ZLA0.72
FUAFUSIDIC ACIDA1QCA0.7
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.7
FUAFUSIDIC ACIDA,B2VUF0.7
DL4(14beta,17alpha,25R)-3-oxocholest-
4-en-26-oic acid
A3GYT0.7
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA1S0X0.77
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA2Q9F0.77
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA,B,C2HKA0.77
VDA(1R,2R,3R,5Z)-17-{(1S)-1-[(2-ethyl-
2-hydroxybutyl)sulfanyl]ethyl}-
2-(2-hydroxyethoxy)-9,10-secoestra-
5,7,16-triene-1,3-diol
A2ZL90.72
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid
A3GYU0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.73
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.73
ERGERGOSTEROLA1BXM0.73
ERGERGOSTEROLA1ZHZ0.73
ERGERGOSTEROLA,B2AIB0.73
2OBCHOLESTERYL OLEATEA2OBD0.78
DOGDIGOXIGENINA1LKE0.7
CLRCHOLESTEROLA,B2ZXE0.76
CLRCHOLESTEROLA1N830.76
CLRCHOLESTEROLA2RH10.76
CLRCHOLESTEROLA1LRI0.76
CLRCHOLESTEROLA1ZHY0.76
CLRCHOLESTEROLA3D4S0.76
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE
A1Q200.74
CLLCHOLESTERYL LINOLEATEA,B1CLE0.78
SNLSPIRONOLACTONEA,B2AB20.79
SNLSPIRONOLACTONEA,B,C,D,E,F2OAX0.79
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.74
HCR7-HYDROXYCHOLESTEROLA1ZHT0.74