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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03403880

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.74
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.74
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.78
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.78
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.78
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.78
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.84
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.84
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.84
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.84
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.84
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.75
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.8
ACA6-AMINOHEXANOIC ACIDA,B2JT90.75
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.75
ACA6-AMINOHEXANOIC ACIDC1ILP0.75
ACA6-AMINOHEXANOIC ACIDA2PK40.75
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.75
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		1VQ60.75
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.75
ACA6-AMINOHEXANOIC ACIDA1PK20.75
ACA6-AMINOHEXANOIC ACIDA2ZM70.75
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		3CMA0.75
ACA6-AMINOHEXANOIC ACIDC1ILQ0.75
ACA6-AMINOHEXANOIC ACIDA2ZM80.75
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		1VQK0.75
ACA6-AMINOHEXANOIC ACIDA2DCF0.75
ACA6-AMINOHEXANOIC ACIDA1HPK0.75
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		1VQ80.75
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		3CME0.75
ACA6-AMINOHEXANOIC ACIDA2ZM90.75
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		1VQN0.75
ACA6-AMINOHEXANOIC ACIDA2ZMA0.75
ACA6-AMINOHEXANOIC ACIDA3KIV0.75
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		1VQ90.75
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.76
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.75
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.75
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.75
DGLD-GLUTAMIC ACIDA,B2JFX0.73
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.73
DGLD-GLUTAMIC ACIDA1C4B0.73
DGLD-GLUTAMIC ACIDA1CW80.73
DGLD-GLUTAMIC ACIDA,D1CZQ0.73
DGLD-GLUTAMIC ACIDA,B2JFY0.73
DGLD-GLUTAMIC ACIDI1QUR0.73
DGLD-GLUTAMIC ACIDA,D2Q3I0.73
DGLD-GLUTAMIC ACIDA1CVQ0.73
DGLD-GLUTAMIC ACIDA,B1P4N0.73
DGLD-GLUTAMIC ACIDA,B2VVT0.73
DGLD-GLUTAMIC ACIDE,S148L0.73
DGLD-GLUTAMIC ACIDA1KR60.73
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.73
DGLD-GLUTAMIC ACIDA1AY30.73
DGLD-GLUTAMIC ACIDA2J8F0.73
DGLD-GLUTAMIC ACIDU2AIZ0.73
DGLD-GLUTAMIC ACIDA,B,C2DWU0.73
DGLD-GLUTAMIC ACIDL2EAX0.73
DGLD-GLUTAMIC ACIDA,B2JFZ0.73
DGLD-GLUTAMIC ACIDH,I4THN0.73
DGLD-GLUTAMIC ACIDA1CWZ0.73
DGLD-GLUTAMIC ACIDP1MCK0.73
DGLD-GLUTAMIC ACIDA2JUE0.73
DGLD-GLUTAMIC ACIDA,B2JFO0.73
DGLD-GLUTAMIC ACIDA3H410.73
DGLD-GLUTAMIC ACIDA1D0K0.73
DGLD-GLUTAMIC ACIDL,N1WCO0.73
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.73
DGLD-GLUTAMIC ACIDH,I5GDS0.73
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.73
DGLD-GLUTAMIC ACIDA,B2JFQ0.73
DGLD-GLUTAMIC ACIDA,B2Q330.73
DGLD-GLUTAMIC ACIDA,B2JFP0.73
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.73
DGLD-GLUTAMIC ACIDA2J8G0.73
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.79
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.79
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.79
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.79
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.79
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.76
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.76
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.76
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.71
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.71
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.71
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.75
DLYD-LYSINEA1C4B0.75
DLYD-LYSINEA,B,C,D3BOG0.75
DLYD-LYSINEA1KO00.75
DLYD-LYSINEA,B,C,D3C1P0.75
DLYD-LYSINEA,B,C,H,K,L2R5D0.75
DLYD-LYSINEA,B,C,D2R3C0.75
DLYD-LYSINEA,B,C,H,K,L2R5B0.75
DLYD-LYSINEA,B2Q330.75
DLYD-LYSINEA,B2ATS0.75
DLYD-LYSINEA1RCQ0.75
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.76
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.76
DOA12-AMINO-DODECANOIC ACIDA2DCX0.76
DOA12-AMINO-DODECANOIC ACIDB1EOL0.76
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.82
API2,6-DIAMINOPIMELIC ACIDA2DAP0.82
API2,6-DIAMINOPIMELIC ACIDE,S148L0.82
6CL6-CARBOXYLYSINEU2AIZ0.82
DNED-NORLEUCINEA1R9V0.75
DNED-NORLEUCINEA,B1S4A0.75
DNED-NORLEUCINEA,B1S1O0.75
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.76