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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02383013

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.75
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.75
DOA12-AMINO-DODECANOIC ACIDA2DCX0.75
DOA12-AMINO-DODECANOIC ACIDB1EOL0.75
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.8
CHGCYCLOHEXYL-GLYCINEH,I4THN0.8
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.8
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.8
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.72
API2,6-DIAMINOPIMELIC ACIDA2DAP0.72
API2,6-DIAMINOPIMELIC ACIDE,S148L0.72
6CL6-CARBOXYLYSINEU2AIZ0.72
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.82
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.82
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.72
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.72
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.74
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COJ0.75
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B,C2EJ30.75
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2A1H0.75
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COI0.75
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.74
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.74
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.74
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.74
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.74
NLH(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acidA,B,I3DCR0.74
NPI2-AMINOPIMELIC ACIDA2TDT0.73
NPI2-AMINOPIMELIC ACIDA1KGQ0.73
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.72
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.78
AC51-AMINOCYCLOPENTANECARBOXYLIC ACIDA,B1Y1M0.8
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.82
ZAL3-cyclohexyl-D-alanineI1HBT0.82
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.73
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.78
2ML2-METHYLLEUCINEA,B,C1I1L0.71
2ML2-METHYLLEUCINEA2RM90.71
2ML2-METHYLLEUCINEA2RMD0.71
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.82
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.82
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.7