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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02114321

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
U51(6E)-7-{6-[(1E)-OCT-1-ENYL]-2,3-
DIAZABICYCLO[2.2.1]HEPT-2-EN-5-
YL}HEPT-6-ENOIC ACID
A,B3B990.71
ZAL3-cyclohexyl-D-alanineI1HBT0.72
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.72
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.72
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
TZATRANS-AMICLENOMYCINA,B1MLZ0.84
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.72
GBCGABACULINEA,B,C1GBN0.79
ACZCIS-AMICLENOMYCINA,B1MLY0.84
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
2NPL-2-AMINO-6-METHYLENE-PIMELIC ACIDA,B1F060.72
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.71
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.71
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.71
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.71
DPQ(S)-2-AMINO-3-(4-HYDROXY-3-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2YX90.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B1MIK0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CSA0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWL0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYA0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D1MF80.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1BCK0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D,E,F,H1M630.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWC0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWI0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D1QNH0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H2RMC0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
T,U,V2POY0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CYN0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D2OJU0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P,R,T
2RMA0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYB0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D1QNG0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B3CYS0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWH0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
G,H
3BO70.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1IKF0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,M,N2Z6W0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P
1C5F0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWO0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D,E,F1XQ70.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWA0.71
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWF0.71
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.71
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.71
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.71