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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03464531

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.83
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.81
ELA9-OCTADECENOIC ACIDA1HMR0.79
EICLINOLEIC ACIDA2Q9S0.79
EICLINOLEIC ACIDA2EVL0.79
EICLINOLEIC ACIDA1IGZ0.79
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.79
OLAOLEIC ACIDA1VYF0.79
OLAOLEIC ACIDA2EV40.79
OLAOLEIC ACIDA1FK50.79
OLAOLEIC ACIDA1FE30.79
OLAOLEIC ACIDA,B2AG40.79
OLAOLEIC ACIDA,B1J780.79
OLAOLEIC ACIDA2E9L0.79
OLAOLEIC ACIDA,B2EV10.79
OLAOLEIC ACIDA1GNI0.79
OLAOLEIC ACIDA1SX60.79
OLAOLEIC ACIDA2E9M0.79
OLAOLEIC ACIDA2FLJ0.79
OLAOLEIC ACIDA2ZOX0.79
OLAOLEIC ACIDA2AF90.79
OLAOLEIC ACIDA,B,C2AG20.79
OLAOLEIC ACIDA2JU80.79
OLAOLEIC ACIDA,B1GT60.79
OLAOLEIC ACIDA,B,C1PMP0.79
OLAOLEIC ACIDA,B1DKF0.79
OLAOLEIC ACIDA1ICN0.79
OLAOLEIC ACIDA1G740.79
OLAOLEIC ACIDA,B1J7E0.79
OLAOLEIC ACIDA1LFO0.79
OLAOLEIC ACIDA1HMS0.79
OLAOLEIC ACIDA2EV30.79
OLAOLEIC ACIDA2EV20.79
OLAOLEIC ACIDA2FTB0.79
OLAOLEIC ACIDA1LID0.79
VCAVACCENIC ACIDA,B2BAW0.79
VCAVACCENIC ACIDA,B2B500.79
VCAVACCENIC ACIDB2ACO0.79
VCAVACCENIC ACIDA,B2AWH0.79
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid		A3GYU0.79
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.79
LNLALPHA-LINOLENIC ACIDA2BYO0.78
LNLALPHA-LINOLENIC ACIDA1FK60.78
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.78
PAMPALMITOLEIC ACIDA,B,C1IZO0.78
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.78
PAMPALMITOLEIC ACIDA1FK30.78
PAMPALMITOLEIC ACIDA,B3EKD0.78
PAMPALMITOLEIC ACIDA2UUH0.78
PAMPALMITOLEIC ACIDA,B1YH80.78
PAMPALMITOLEIC ACIDA,B1YHC0.78
PAMPALMITOLEIC ACIDA1UVB0.78
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.77
OPD9R,13R-12-OXOPHYTODIENOIC ACIDA,B1ICQ0.77
CDZ3,5-dihydroxy-4,6,6-tris(3-methylbut-
2-en-1-yl)-2-(2-methylpropanoyl)cyclohexa-
2,4-dien-1-one		A2QNV0.76
DL4(14beta,17alpha,25R)-3-oxocholest-
4-en-26-oic acid		A3GYT0.76
HEQ3-[18-(4-HYDROXY-2,6,6-TRIMETHYL-
CYCLOHEX-1-ENYL)-3,7,12,16-TETRAMETHYL-
OCTADECA-1,3,5,7,9,11,13,15, 17-
NONAENYL]-2,4,4-TRIMETHYL-CYCLOHEX-
2-ENONE		A,B1M980.75
REARETINOIC ACIDA1CBS0.75
REARETINOIC ACIDA,B1EPB0.75
REARETINOIC ACIDA,D1K740.75
REARETINOIC ACIDA,D3E000.75
REARETINOIC ACIDA3LBD0.75
REARETINOIC ACIDA,B,C,D,E,F,
G,H		1XLS0.75
REARETINOIC ACIDA,B,C,D,E,F,
G,H		2ACL0.75
REARETINOIC ACIDA,B,C,D3FAL0.75
REARETINOIC ACIDA,D,U,X1FM60.75
REARETINOIC ACIDE,F1RLB0.75
REARETINOIC ACIDA,D3DZU0.75
REARETINOIC ACIDA3CWK0.75
REARETINOIC ACIDA,B2NNH0.75
REARETINOIC ACIDA,B2VE30.75
REARETINOIC ACIDA1N4H0.75
REARETINOIC ACIDA2FR30.75
REARETINOIC ACIDB,C1G5Y0.75
REARETINOIC ACIDA2LBD0.75
REARETINOIC ACIDA,B,E,F1XDK0.75
REARETINOIC ACIDA,D1FM90.75
REARETINOIC ACIDA1FEM0.75
REARETINOIC ACIDA,D3DZY0.75
REARETINOIC ACIDA,B1TYR0.75
REARETINOIC ACIDA2G780.75
REARETINOIC ACIDA1GX90.75
REARETINOIC ACIDA,B,C,D3FC60.75
REARETINOIC ACIDA,B1CBR0.75
REARETINOIC ACIDA,B1FBY0.75
REARETINOIC ACIDA,B1XIU0.75
SIMSIMVASTATINA,B,C,D1HW90.74
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.73
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE		A2AMB0.73
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.73
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.73
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.73
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.73
VTQRRR-ALPHA-TOCOPHERYLQUINONEA,C,E1OLM0.73
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A,B2ZK10.73
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A2ZK20.73
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.73
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.73
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE		A1E3G0.73
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE		A,B1E3K0.73
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE		A2AO60.73
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE		A1XOW0.73
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE		A1XQ30.73
0MAmaslinic acidA2QN20.72
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,B1T020.72
114COMPACTINA,B,C,D1HW80.72
RCLRICINOLEIC ACIDA2CM40.72
RCLRICINOLEIC ACIDA2CM90.72
RCLRICINOLEIC ACIDA1FK70.72
803LOVASTATINA,B1CQP0.72
AXTASTAXANTHINA,B1GKA0.72
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID		A2W4Q0.71
MEI(2E,4E)-11-METHOXY-3,7,11-TRIMETHYLDODECA-
2,4-DIENOIC ACID		A,B1UHL0.71
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.71
LYRN~6~-[(2Z,4E,6E,8E)-3,7-DIMETHYL-
9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-
1-YL)NONA-2,4,6,8-TETRAENYL]LYSINE		A,B2J4Y0.71
RE96-(2,3,4,5,6,7-HEXAHYDRO-2,4,4-
TRIMETHYL-1-METYLENEINDEN-2-YL)-
3-METHYLHEXA-2,4-DIENOIC ACID		A1CBQ0.71
T24(9Z,11E,13S,15Z)-13-hydroxyoctadeca-
9,11,15-trienoic acid		A,B3DSI0.71
OXR4-OXORETINOLA,B1X8L0.71
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,C1YA80.71
LIK3,6-BIS(METHYLENE)DECANOIC ACIDA2HLV0.7
HYF4-HYDROXY-5-ISOBUTYRYL-6-METHYL-
1,3,7-TRIS-(3-METHYL-BUT-2-ENYL)-
6-(4-METHYL-PENT-3-ENYL)-BICYCLO[3.3.1]NON-
3-ENE-2,9-DIONE		A1M130.7