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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03294267

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid
A,B2VSR0.72
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.7
SIMSIMVASTATINA,B,C,D1HW90.73
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid
A,B2VV40.78
EAH(5S,7E,9E,11Z,14Z)-5-hydroxyicosa-
7,9,11,14-tetraenoic acid
A3DZT0.71
OPD9R,13R-12-OXOPHYTODIENOIC ACIDA,B1ICQ0.76
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,B1T020.75
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,C1YA80.74
T24(9Z,11E,13S,15Z)-13-hydroxyoctadeca-
9,11,15-trienoic acid
A,B3DSI0.72
114COMPACTINA,B,C,D1HW80.75
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2HFK0.82
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID
A1IK30.73
803LOVASTATINA,B1CQP0.75
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid
A,B2RCL0.76
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid
A,B3DSK0.76
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid
A,B3DSJ0.72
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid
A,B2RCH0.72
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid
A,B2VST0.72
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE
A1Q200.71
13T13-DEOXYTEDANOLIDE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z
2OTJ0.71
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID
A,B2G5W0.81
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.73
1642-(3-CARBOXYPROPIONYL)-6-HYDROXY-
CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID
A1R6W0.73
MPG1-MONOOLEOYL-RAC-GLYCEROLA2GUF0.71
MPG1-MONOOLEOYL-RAC-GLYCEROLA,B1E120.71
6OB(8E,10S,12Z)-10-hydroxy-6-oxooctadeca-
8,12-dienoic acid
A,B2VV40.77
1NB2-(2-HYDROXY-CYCLOPENTYL)-PENT-
4-ENAL
P1BRU0.74
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate
A3D4S0.75
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID
A1IK30.72
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.72
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,D1AWH0.71
OLAOLEIC ACIDA1VYF0.7
OLAOLEIC ACIDA2EV40.7
OLAOLEIC ACIDA1FK50.7
OLAOLEIC ACIDA1FE30.7
OLAOLEIC ACIDA,B2AG40.7
OLAOLEIC ACIDA,B1J780.7
OLAOLEIC ACIDA2E9L0.7
OLAOLEIC ACIDA,B2EV10.7
OLAOLEIC ACIDA1GNI0.7
OLAOLEIC ACIDA1SX60.7
OLAOLEIC ACIDA2E9M0.7
OLAOLEIC ACIDA2FLJ0.7
OLAOLEIC ACIDA2ZOX0.7
OLAOLEIC ACIDA2AF90.7
OLAOLEIC ACIDA,B,C2AG20.7
OLAOLEIC ACIDA2JU80.7
OLAOLEIC ACIDA,B1GT60.7
OLAOLEIC ACIDA,B,C1PMP0.7
OLAOLEIC ACIDA,B1DKF0.7
OLAOLEIC ACIDA1ICN0.7
OLAOLEIC ACIDA1G740.7
OLAOLEIC ACIDA,B1J7E0.7
OLAOLEIC ACIDA1LFO0.7
OLAOLEIC ACIDA1HMS0.7
OLAOLEIC ACIDA2EV30.7
OLAOLEIC ACIDA2EV20.7
OLAOLEIC ACIDA2FTB0.7
OLAOLEIC ACIDA1LID0.7
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid
A3DBM0.72
ELA9-OCTADECENOIC ACIDA1HMR0.7
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID
A2ZB40.91
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID
A,B1V3V0.91
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.7
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,B,E1R8Q0.71
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A1RE00.71
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,E1S9D0.71
EICLINOLEIC ACIDA2Q9S0.7
EICLINOLEIC ACIDA2EVL0.7
EICLINOLEIC ACIDA1IGZ0.7
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.72
PGX7-[6-(3-HYDROPEROXY-OCT-1-ENYL)-
2,3-DIOXA-BICYCLO[2.2.1]HEPT-5-
YL]-HEPT-5-ENOIC ACID
A,B,C,D1DDX0.78
GMMGLUCOSE MONOMYCOLATEA1UQS0.72
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.71
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.71
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.71
RCLRICINOLEIC ACIDA2CM40.79
RCLRICINOLEIC ACIDA2CM90.79
RCLRICINOLEIC ACIDA1FK70.79
VCAVACCENIC ACIDA,B2BAW0.7
VCAVACCENIC ACIDA,B2B500.7
VCAVACCENIC ACIDB2ACO0.7
VCAVACCENIC ACIDA,B2AWH0.7
PG2PROSTAGLANDIN D2A,B1RY00.91