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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02445001

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.84
VCAVACCENIC ACIDA,B2BAW0.84
VCAVACCENIC ACIDA,B2B500.84
VCAVACCENIC ACIDB2ACO0.84
VCAVACCENIC ACIDA,B2AWH0.84
EICLINOLEIC ACIDA2Q9S0.84
EICLINOLEIC ACIDA2EVL0.84
EICLINOLEIC ACIDA1IGZ0.84
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.84
ELA9-OCTADECENOIC ACIDA1HMR0.84
OLAOLEIC ACIDA1VYF0.84
OLAOLEIC ACIDA2EV40.84
OLAOLEIC ACIDA1FK50.84
OLAOLEIC ACIDA1FE30.84
OLAOLEIC ACIDA,B2AG40.84
OLAOLEIC ACIDA,B1J780.84
OLAOLEIC ACIDA2E9L0.84
OLAOLEIC ACIDA,B2EV10.84
OLAOLEIC ACIDA1GNI0.84
OLAOLEIC ACIDA1SX60.84
OLAOLEIC ACIDA2E9M0.84
OLAOLEIC ACIDA2FLJ0.84
OLAOLEIC ACIDA2ZOX0.84
OLAOLEIC ACIDA2AF90.84
OLAOLEIC ACIDA,B,C2AG20.84
OLAOLEIC ACIDA2JU80.84
OLAOLEIC ACIDA,B1GT60.84
OLAOLEIC ACIDA,B,C1PMP0.84
OLAOLEIC ACIDA,B1DKF0.84
OLAOLEIC ACIDA1ICN0.84
OLAOLEIC ACIDA1G740.84
OLAOLEIC ACIDA,B1J7E0.84
OLAOLEIC ACIDA1LFO0.84
OLAOLEIC ACIDA1HMS0.84
OLAOLEIC ACIDA2EV30.84
OLAOLEIC ACIDA2EV20.84
OLAOLEIC ACIDA2FTB0.84
OLAOLEIC ACIDA1LID0.84
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.82
PAMPALMITOLEIC ACIDA,B,C1IZO0.82
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.82
PAMPALMITOLEIC ACIDA1FK30.82
PAMPALMITOLEIC ACIDA,B3EKD0.82
PAMPALMITOLEIC ACIDA2UUH0.82
PAMPALMITOLEIC ACIDA,B1YH80.82
PAMPALMITOLEIC ACIDA,B1YHC0.82
PAMPALMITOLEIC ACIDA1UVB0.82
LNLALPHA-LINOLENIC ACIDA2BYO0.82
LNLALPHA-LINOLENIC ACIDA1FK60.82
OPD9R,13R-12-OXOPHYTODIENOIC ACIDA,B1ICQ0.81
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.81
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.81
LIK3,6-BIS(METHYLENE)DECANOIC ACIDA2HLV0.8
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.79
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1W3M0.77
RCLRICINOLEIC ACIDA2CM40.76
RCLRICINOLEIC ACIDA2CM90.76
RCLRICINOLEIC ACIDA1FK70.76
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.74
ACDARACHIDONIC ACIDA1DIY0.73
ACDARACHIDONIC ACIDA1VYG0.73
ACDARACHIDONIC ACIDA1U670.73
ACDARACHIDONIC ACIDA1GNJ0.73
ACDARACHIDONIC ACIDA1ADL0.73
ACDARACHIDONIC ACIDA,B1CVU0.73
1NB2-(2-HYDROXY-CYCLOPENTYL)-PENT-
4-ENAL		P1BRU0.73
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.73
DCRicosanoic acidA,B,C,D3EUT0.72
F23TRICOSANOIC ACIDA,B1LLF0.72
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.72
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B2RCL0.72
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B3DSK0.72
STESTEARIC ACIDA,B1XXS0.72
STESTEARIC ACIDA,B3CJD0.72
STESTEARIC ACIDA,B1UVC0.72
STESTEARIC ACIDA1K4W0.72
STESTEARIC ACIDA1E7I0.72
STESTEARIC ACIDA1FK40.72
STESTEARIC ACIDA1HMT0.72
STESTEARIC ACIDA1LIF0.72
STESTEARIC ACIDA2FVA0.72
STESTEARIC ACIDA,B3FLV0.72
STESTEARIC ACIDA3EML0.72
4R8(6E,10Z,13Z,16Z,19Z)-4-oxodocosa-
6,10,13,16,19-pentaenoic acid		A2VV30.72
PLMPALMITIC ACIDA2UUI0.72
PLMPALMITIC ACIDA,B,C,D,E,F2UWH0.72
PLMPALMITIC ACIDA,B3EPY0.72
PLMPALMITIC ACIDA,B2W3Y0.72
PLMPALMITIC ACIDA1JTB0.72
PLMPALMITIC ACIDA1M670.72
PLMPALMITIC ACIDA2Z6V0.72
PLMPALMITIC ACIDA,B1E120.72
PLMPALMITIC ACIDA,B2GO30.72
PLMPALMITIC ACIDA,B,C2NWL0.72
PLMPALMITIC ACIDA1MDC0.72
PLMPALMITIC ACIDA,B3BDQ0.72
PLMPALMITIC ACIDA3BFH0.72
PLMPALMITIC ACIDA2DT80.72
PLMPALMITIC ACIDA,B2IES0.72
PLMPALMITIC ACID1,41EV10.72
PLMPALMITIC ACIDA3BKR0.72
PLMPALMITIC ACIDA,B1VPV0.72
PLMPALMITIC ACIDA,B,C3EGL0.72
PLMPALMITIC ACIDA2E9M0.72
PLMPALMITIC ACIDA2VN00.72
PLMPALMITIC ACIDA,B2HPY0.72
PLMPALMITIC ACIDA1N1G0.72
PLMPALMITIC ACIDA,B,C2NWX0.72
PLMPALMITIC ACIDA1B0O0.72
PLMPALMITIC ACIDA2ZIY0.72
PLMPALMITIC ACIDA1ACA0.72
PLMPALMITIC ACIDA2ZWS0.72
PLMPALMITIC ACIDA3FYS0.72
PLMPALMITIC ACIDA,B1L9H0.72
PLMPALMITIC ACIDA1SZ70.72
PLMPALMITIC ACIDA,C,E1O6U0.72
PLMPALMITIC ACIDA,B2NNH0.72
PLMPALMITIC ACIDA,B2DEB0.72
PLMPALMITIC ACIDA,B,C2DQZ0.72
PLMPALMITIC ACIDA2FIK0.72
PLMPALMITIC ACIDA1M660.72
PLMPALMITIC ACID1,41HXS0.72
PLMPALMITIC ACIDA,B2Z730.72
PLMPALMITIC ACIDA2PFC0.72
PLMPALMITIC ACIDA2IFB0.72
PLMPALMITIC ACIDA2HMB0.72
PLMPALMITIC ACIDA1EH50.72
PLMPALMITIC ACIDA,B3CAP0.72
PLMPALMITIC ACIDA,B1U190.72
PLMPALMITIC ACIDA,B,C2DQY0.72
PLMPALMITIC ACIDA,C2Q7Y0.72
PLMPALMITIC ACIDA1BE20.72
PLMPALMITIC ACIDA,B1PQ20.72
PLMPALMITIC ACIDA,B1HZX0.72
PLMPALMITIC ACIDA1NVL0.72
PLMPALMITIC ACIDA,B2PED0.72
PLMPALMITIC ACIDA1O8V0.72
PLMPALMITIC ACIDA,B1GZM0.72
PLMPALMITIC ACIDA2JAF0.72
PLMPALMITIC ACIDA2NNI0.72
PLMPALMITIC ACIDA2E9L0.72
PLMPALMITIC ACIDA1LIE0.72
PLMPALMITIC ACIDA3BKS0.72
PLMPALMITIC ACIDE,K,Q,W3CUE0.72
PLMPALMITIC ACIDA3DQB0.72
PLMPALMITIC ACIDA2HNX0.72
PLMPALMITIC ACIDA1PZ40.72
PLMPALMITIC ACIDA1MGP0.72
PLMPALMITIC ACIDA1MZM0.72
PLMPALMITIC ACIDA2NNJ0.72
PLMPALMITIC ACIDA1E7H0.72
PLMPALMITIC ACIDA,B1PZX0.72
PLMPALMITIC ACIDA1URE0.72
PLMPALMITIC ACIDA2RH10.72
PLMPALMITIC ACIDA2UUH0.72
PLMPALMITIC ACIDA3C9L0.72
PLMPALMITIC ACIDA,B2QZT0.72
PLMPALMITIC ACID1,41COV0.72
PLMPALMITIC ACIDA,B2IER0.72
PLMPALMITIC ACIDA,B,C2IU80.72
PLMPALMITIC ACIDA,B,C2IUA0.72
PLMPALMITIC ACIDA1LV20.72
PLMPALMITIC ACIDA3DBX0.72
PLMPALMITIC ACIDA1B560.72
PLMPALMITIC ACIDA2JAG0.72
PLMPALMITIC ACIDA,B,C2I360.72
PLMPALMITIC ACIDA,B,C2IU90.72
PLMPALMITIC ACIDA,B2G870.72
PLMPALMITIC ACIDA1GXA0.72
PLMPALMITIC ACIDA2ZOX0.72
PLMPALMITIC ACIDA2I350.72
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.71
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.71
PG2PROSTAGLANDIN D2A,B1RY00.71
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.71
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.71
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.71
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.71
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.71
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.71
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid		A3GYU0.7
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE		A,B2HFK0.7