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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009029

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,B2AEB0.78
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.74
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.74
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.74
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.74
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.74
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.74
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.74
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.74
ACA6-AMINOHEXANOIC ACIDA,B2JT90.72
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.72
ACA6-AMINOHEXANOIC ACIDC1ILP0.72
ACA6-AMINOHEXANOIC ACIDA2PK40.72
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.72
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		1VQ60.72
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.72
ACA6-AMINOHEXANOIC ACIDA1PK20.72
ACA6-AMINOHEXANOIC ACIDA2ZM70.72
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		3CMA0.72
ACA6-AMINOHEXANOIC ACIDC1ILQ0.72
ACA6-AMINOHEXANOIC ACIDA2ZM80.72
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		1VQK0.72
ACA6-AMINOHEXANOIC ACIDA2DCF0.72
ACA6-AMINOHEXANOIC ACIDA1HPK0.72
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		1VQ80.72
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		3CME0.72
ACA6-AMINOHEXANOIC ACIDA2ZM90.72
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		1VQN0.72
ACA6-AMINOHEXANOIC ACIDA2ZMA0.72
ACA6-AMINOHEXANOIC ACIDA3KIV0.72
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		1VQ90.72
DAVDELTA-AMINO VALERIC ACIDA1H7O0.82
DAVDELTA-AMINO VALERIC ACIDA7JDW0.82
6HN6-nitro-L-norleucineA,B3F800.71
BGTTERT-BUTYL D-ALPHA-GLUTAMINATEA,B2AFU0.75
ABAALPHA-AMINOBUTYRIC ACIDA1A3P0.73
ABAALPHA-AMINOBUTYRIC ACIDA,S1RBD0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1ZII0.73
ABAALPHA-AMINOBUTYRIC ACIDM,N,O,P2ZSW0.73
ABAALPHA-AMINOBUTYRIC ACIDA1T9E0.73
ABAALPHA-AMINOBUTYRIC ACIDC,D2OJU0.73
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P,R,T		2RMA0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6M0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1Z1H0.73
ABAALPHA-AMINOBUTYRIC ACIDA1CYA0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,D1MF80.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,D2J9K0.73
ABAALPHA-AMINOBUTYRIC ACIDD,E,F1XQ70.73
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P		1C5F0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,I8HVP0.73
ABAALPHA-AMINOBUTYRIC ACIDA1W9N0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CWA0.73
ABAALPHA-AMINOBUTYRIC ACIDA1MQX0.73
ABAALPHA-AMINOBUTYRIC ACIDE,S1Z3L0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C7HVP0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6J0.73
ABAALPHA-AMINOBUTYRIC ACIDC1IKF0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B3BXS0.73
ABAALPHA-AMINOBUTYRIC ACIDA,M,N2Z6W0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1D4K0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,I4HVP0.73
ABAALPHA-AMINOBUTYRIC ACIDA2JUV0.73
ABAALPHA-AMINOBUTYRIC ACIDA1AJ10.73
ABAALPHA-AMINOBUTYRIC ACIDB3CYS0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1YLC0.73
ABAALPHA-AMINOBUTYRIC ACIDA1C2U0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C2J9J0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CWB0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F1QOW0.73
ABAALPHA-AMINOBUTYRIC ACIDD1QNG0.73
ABAALPHA-AMINOBUTYRIC ACIDA9JDW0.73
ABAALPHA-AMINOBUTYRIC ACIDA1CYB0.73
ABAALPHA-AMINOBUTYRIC ACIDA1WZ50.73
ABAALPHA-AMINOBUTYRIC ACIDA3HVP0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6P0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CYN0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1MTR0.73
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H2RMC0.73
ABAALPHA-AMINOBUTYRIC ACIDA1BBO0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,D,E,F,H1M630.73
ABAALPHA-AMINOBUTYRIC ACIDE,F2ZOL0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B3BXR0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CWM0.73
ABAALPHA-AMINOBUTYRIC ACIDA1CSA0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1D4L0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CWL0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1Z1R0.73
ABAALPHA-AMINOBUTYRIC ACIDA,C,F,H2C5V0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F2ZSV0.73
ABAALPHA-AMINOBUTYRIC ACIDA,C,E,G,I,J,
K,L		2ZOK0.73
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P,R,T		2RMB0.73
ABAALPHA-AMINOBUTYRIC ACIDA1MQZ0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F,
I,J,K,L,M,N		2ESL0.73
ABAALPHA-AMINOBUTYRIC ACIDC1CWH0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F,
G,H		3BO70.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1YLD0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,I3DCR0.73
ABAALPHA-AMINOBUTYRIC ACIDA,I2O400.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1K090.73
ABAALPHA-AMINOBUTYRIC ACIDB1T1Q0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6K0.73
ABAALPHA-AMINOBUTYRIC ACIDA1MQY0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,I3DCK0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6L0.73
ABAALPHA-AMINOBUTYRIC ACIDA2DDE0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C1CPI0.73
ABAALPHA-AMINOBUTYRIC ACIDA,B,C1ZIJ0.73
ABAALPHA-AMINOBUTYRIC ACIDA1BAH0.73
ABAALPHA-AMINOBUTYRIC ACIDC,D1QNH0.73
ABAALPHA-AMINOBUTYRIC ACIDT,U,V2POY0.73
4FB(4S)-4-FLUORO-L-PROLINEA2Q6P0.71
CIRCITRULLINEA,B,C,D1J210.75
CIRCITRULLINEB1KOD0.75
CIRCITRULLINEA,B,C3B3I0.75
CIRCITRULLINEC3DTX0.75
CIRCITRULLINEA2C6Z0.75
CIRCITRULLINEA,C,E,F2W650.75
CIRCITRULLINEA,B2JAI0.75
CIRCITRULLINEP3FT20.75
CIRCITRULLINEA,B,C,D1J1Z0.75
CIRCITRULLINEA,B1LXY0.75
CIRCITRULLINEF,H1OL10.75
CIRCITRULLINEA1KP30.75
CIRCITRULLINEA2NZ20.75
CIRCITRULLINEA1H700.75
CIRCITRULLINEA1K970.75
CIRCITRULLINEC3B6S0.75
DARD-ARGININEA,B2Q330.71
DARD-ARGININEA,B,E,F,G,H1MHW0.71
DARD-ARGININEA2JUE0.71
DARD-ARGININEH,I1A4W0.71
DARD-ARGININEA1BDK0.71
DARD-ARGININEA1CWZ0.71
DARD-ARGININEB1CFA0.71
DARD-ARGININEB,C3BV90.71
DARD-ARGININEA1CVQ0.71
DARD-ARGININEA1P520.71
DARD-ARGININEA,D1CZQ0.71
DARD-ARGININEA1CW80.71
DARD-ARGININEA,B,C,D3BOG0.71
DARD-ARGININEA1BFW0.71
DARD-ARGININEA1BG00.71
6CL6-CARBOXYLYSINEU2AIZ0.76
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.76
API2,6-DIAMINOPIMELIC ACIDA2DAP0.76
API2,6-DIAMINOPIMELIC ACIDE,S148L0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.79
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.79
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.79
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.79
CAB4-CARBOXY-4-AMINOBUTANALA,B,M,N1FJM0.73
CAB4-CARBOXY-4-AMINOBUTANALC,I2IE30.73
CAB4-CARBOXY-4-AMINOBUTANALC,F,X,Y2NPP0.73
CAB4-CARBOXY-4-AMINOBUTANALA,B1DJO0.73
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.71
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.71
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.76
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.76
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.75
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.74
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.74
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.73
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.71
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.71