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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482402

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.86
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.75
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.72
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1CEB0.7
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID		A1B2I0.7
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.85
DGLD-GLUTAMIC ACIDA,B2JFX0.72
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.72
DGLD-GLUTAMIC ACIDA1C4B0.72
DGLD-GLUTAMIC ACIDA1CW80.72
DGLD-GLUTAMIC ACIDA,D1CZQ0.72
DGLD-GLUTAMIC ACIDA,B2JFY0.72
DGLD-GLUTAMIC ACIDI1QUR0.72
DGLD-GLUTAMIC ACIDA,D2Q3I0.72
DGLD-GLUTAMIC ACIDA1CVQ0.72
DGLD-GLUTAMIC ACIDA,B1P4N0.72
DGLD-GLUTAMIC ACIDA,B2VVT0.72
DGLD-GLUTAMIC ACIDE,S148L0.72
DGLD-GLUTAMIC ACIDA1KR60.72
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.72
DGLD-GLUTAMIC ACIDA1AY30.72
DGLD-GLUTAMIC ACIDA2J8F0.72
DGLD-GLUTAMIC ACIDU2AIZ0.72
DGLD-GLUTAMIC ACIDA,B,C2DWU0.72
DGLD-GLUTAMIC ACIDL2EAX0.72
DGLD-GLUTAMIC ACIDA,B2JFZ0.72
DGLD-GLUTAMIC ACIDH,I4THN0.72
DGLD-GLUTAMIC ACIDA1CWZ0.72
DGLD-GLUTAMIC ACIDP1MCK0.72
DGLD-GLUTAMIC ACIDA2JUE0.72
DGLD-GLUTAMIC ACIDA,B2JFO0.72
DGLD-GLUTAMIC ACIDA3H410.72
DGLD-GLUTAMIC ACIDA1D0K0.72
DGLD-GLUTAMIC ACIDL,N1WCO0.72
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.72
DGLD-GLUTAMIC ACIDH,I5GDS0.72
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.72
DGLD-GLUTAMIC ACIDA,B2JFQ0.72
DGLD-GLUTAMIC ACIDA,B2Q330.72
DGLD-GLUTAMIC ACIDA,B2JFP0.72
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.72
DGLD-GLUTAMIC ACIDA2J8G0.72
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.72
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
6CL6-CARBOXYLYSINEU2AIZ0.92
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.9
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.92
API2,6-DIAMINOPIMELIC ACIDA2DAP0.92
API2,6-DIAMINOPIMELIC ACIDE,S148L0.92
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.72
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.72
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.81
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.81
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.81
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.81
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.81
6HN6-nitro-L-norleucineA,B3F800.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.88
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.88
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.88
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.88
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.77
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.83
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.71
CPI6-CARBOXYPIPERIDINEB1EOL0.71
CPI6-CARBOXYPIPERIDINEB1EOJ0.71
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L		1W3M0.71
CPI6-CARBOXYPIPERIDINEA,B2ITK0.71
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.71
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.76
2NPL-2-AMINO-6-METHYLENE-PIMELIC ACIDA,B1F060.73
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.77
CHGCYCLOHEXYL-GLYCINEH,I4THN0.77
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.77
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.77