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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02863347

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.71
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.73
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.78
DO22-AMINO-6-OXO-HEXANOIC ACIDA,B1DJP0.76
DNED-NORLEUCINEA1R9V0.76
DNED-NORLEUCINEA,B1S4A0.76
DNED-NORLEUCINEA,B1S1O0.76
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.78
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.78
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.71
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1CEB0.7
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID		A1B2I0.7
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.74
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.74
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.75
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.75
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.75
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.77
ACA6-AMINOHEXANOIC ACIDA,B2JT90.77
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.77
ACA6-AMINOHEXANOIC ACIDC1ILP0.77
ACA6-AMINOHEXANOIC ACIDA2PK40.77
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ60.77
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.77
ACA6-AMINOHEXANOIC ACIDA1PK20.77
ACA6-AMINOHEXANOIC ACIDA2ZM70.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,D,F,H,
J,K,L,M,N,O,
Q,R,S,T,U,Y,Z		3CMA0.77
ACA6-AMINOHEXANOIC ACIDC1ILQ0.77
ACA6-AMINOHEXANOIC ACIDA2ZM80.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQK0.77
ACA6-AMINOHEXANOIC ACIDA2DCF0.77
ACA6-AMINOHEXANOIC ACIDA1HPK0.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ80.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		3CME0.77
ACA6-AMINOHEXANOIC ACIDA2ZM90.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z		1VQN0.77
ACA6-AMINOHEXANOIC ACIDA2ZMA0.77
ACA6-AMINOHEXANOIC ACIDA3KIV0.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ90.77
ZAL3-cyclohexyl-D-alanineI1HBT0.7
SSC(2S,5S)-5-CARBOXYMETHYLPROLINEA,B,C,D1Q190.81
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.78
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.78
DOA12-AMINO-DODECANOIC ACIDA2DCX0.78
DOA12-AMINO-DODECANOIC ACIDB1EOL0.78
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.73
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.73
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.73
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.75
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.84
API2,6-DIAMINOPIMELIC ACIDA2DAP0.84
API2,6-DIAMINOPIMELIC ACIDE,S148L0.84
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.71
CHGCYCLOHEXYL-GLYCINEH,I4THN0.71
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.71
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.71
6CL6-CARBOXYLYSINEU2AIZ0.84
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.73
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.7
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.87
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.87
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.87
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.87
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.87
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.82
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.76
DLYD-LYSINEA1C4B0.76
DLYD-LYSINEA,B,C,D3BOG0.76
DLYD-LYSINEA1KO00.76
DLYD-LYSINEA,B,C,D3C1P0.76
DLYD-LYSINEA,B,C,H,K,L2R5D0.76
DLYD-LYSINEA,B,C,D2R3C0.76
DLYD-LYSINEA,B,C,H,K,L2R5B0.76
DLYD-LYSINEA,B2Q330.76
DLYD-LYSINEA,B2ATS0.76
DLYD-LYSINEA1RCQ0.76
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.74
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.78
NLENORLEUCINEA1MMT0.76
NLENORLEUCINEA,B1JB60.76
NLENORLEUCINEC1K2B0.76
NLENORLEUCINEA,B,C2AVQ0.76
NLENORLEUCINEC,D,I,L1R1L0.76
NLENORLEUCINEE,S2RLN0.76
NLENORLEUCINEE,S1Z3L0.76
NLENORLEUCINEA,B,C2AOD0.76
NLENORLEUCINEA,B,C2J9J0.76
NLENORLEUCINEA,B,I4HVP0.76
NLENORLEUCINEA,B,C2AVM0.76
NLENORLEUCINEB,C1K1T0.76
NLENORLEUCINEA,B,C2AOC0.76
NLENORLEUCINEA,B,C2JE40.76
NLENORLEUCINEA,B,I3DCK0.76
NLENORLEUCINEB1EOL0.76
NLENORLEUCINEA1FF00.76
NLENORLEUCINEA1FG60.76
NLENORLEUCINEA1FGC0.76
NLENORLEUCINEE,S1Z3M0.76
NLENORLEUCINEA2RME0.76
NLENORLEUCINEB1FGL0.76
NLENORLEUCINEC1K1U0.76
NLENORLEUCINEA,B1B7H0.76
NLENORLEUCINEA1HTH0.76
NLENORLEUCINEA,B,D2J9K0.76
NLENORLEUCINEA2RMD0.76
NLENORLEUCINEA,B,C2AOG0.76
NLENORLEUCINEA2RMI0.76
NLENORLEUCINEI1EPO0.76
NLENORLEUCINEA1FFI0.76
NLENORLEUCINEA1HD90.76
NLENORLEUCINEA1FFF0.76
NLENORLEUCINEB2JND0.76
NLENORLEUCINEA1FEJ0.76
NLENORLEUCINEA2K9E0.76
NLENORLEUCINEC1CFN0.76
NLENORLEUCINEC1K2C0.76
NLENORLEUCINEA1WY40.76
NLENORLEUCINEA1FQ80.76
NLENORLEUCINEA,B1S1O0.76
NLENORLEUCINEA2F4K0.76
NLENORLEUCINEA,B1D5E0.76
NLENORLEUCINEA2JX40.76
NLENORLEUCINEA1FG80.76
NLENORLEUCINEA1WY30.76
NLENORLEUCINEI1YTJ0.76
NLENORLEUCINEA,B,I3DCR0.76
NLENORLEUCINEA,I2O400.76
NLENORLEUCINEA,B2GYP0.76
NLENORLEUCINEC,F1A8K0.76
NLENORLEUCINEC1BAI0.76
NLENORLEUCINEA,B2JT90.76
NLENORLEUCINEA2RM90.76
NLENORLEUCINEA,B1DAZ0.76
NLENORLEUCINEA1F3R0.76
NLENORLEUCINEA,I2JXR0.76
NLENORLEUCINEC,F1A940.76
NLENORLEUCINEA,B1S4A0.76
NLENORLEUCINEA1R9V0.76
NLENORLEUCINEA,B,C,D,E,F2Z2T0.76
NPI2-AMINOPIMELIC ACIDA2TDT0.85
NPI2-AMINOPIMELIC ACIDA1KGQ0.85
DAVDELTA-AMINO VALERIC ACIDA1H7O0.75
DAVDELTA-AMINO VALERIC ACIDA7JDW0.75
NLH(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acidA,B,I3DCR0.76
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.77
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.76
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.76
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.76
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.83
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.78
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.73
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.73
VIG4-AMINO HEXANOIC ACIDA,B,C,D1OHW0.75
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.79
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.79
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.8
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.81
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.81
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.81
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.81
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.81
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.74
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.75
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.87
B3D3-AMINOPENTANEDIOIC ACIDA,B,C2OXJ0.73
B3D3-AMINOPENTANEDIOIC ACIDA,B,C,D3C3F0.73
B3D3-AMINOPENTANEDIOIC ACIDA2OXK0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3G0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3H0.73
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.72
ORNORNITHINEE1LAH0.75
ORNORNITHINEB,C,E,F,H,I,
K,L		1JDB0.75
ORNORNITHINEA,Y1TK20.75
ORNORNITHINEA,B,C2W6U0.75
ORNORNITHINEA1T5M0.75
ORNORNITHINEA,B,C,D,E,G,H1BXR0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1KEE0.75
ORNORNITHINEA,B,C1HQG0.75
ORNORNITHINEA,B,C2W6T0.75
ORNORNITHINEA,B1X7D0.75
ORNORNITHINEA1T5N0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1CE80.75
ORNORNITHINEA1DSR0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1A9X0.75
ORNORNITHINEH,K,L,M,P,R1N0X0.75
ORNORNITHINEA,B2PM50.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1CS00.75
ORNORNITHINEE,I1QR30.75
ORNORNITHINEA1HTH0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1M6V0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1C3O0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1C300.75
ORNORNITHINEA1XT70.75
ORNORNITHINEA3JDW0.75
ORNORNITHINEA,B,C,D,E,F,
G,H		1T360.75
ORNORNITHINEA,B1B2H0.75
ORNORNITHINEA,B,C,D,E,F4CEV0.75
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.74
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.74
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.74
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.74
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.74