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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03033943

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DON6-DIAZENYL-5-OXO-L-NORLEUCINEA,B2OSU0.71
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.74
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.74
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.7
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.7
6CL6-CARBOXYLYSINEU2AIZ0.7
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.72
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.72
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.72
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.76
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.72
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.72
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.72
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.72
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.7
API2,6-DIAMINOPIMELIC ACIDA2DAP0.7
API2,6-DIAMINOPIMELIC ACIDE,S148L0.7
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.74
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.7
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.7
DNMN-METHYL-D-NORLEUCINEA1R9V0.7
ONL5-OXO-L-NORLEUCINEA,B1ECG0.76
ONL5-OXO-L-NORLEUCINEA,B,C,D3DLA0.76
ONL5-OXO-L-NORLEUCINEA,X2Q3Z0.76
ONL5-OXO-L-NORLEUCINEA,B1ECC0.76
ONL5-OXO-L-NORLEUCINEA,B3BRM0.76
ONL5-OXO-L-NORLEUCINEA,B1OFE0.76
ONL5-OXO-L-NORLEUCINEA,B2J6H0.76
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.75
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.73
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
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.75
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.75
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.75
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.7
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.7
POMCIS-5-METHYL-4-OXOPROLINEA,B1A7Z0.75
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.7
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.7
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.7
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.72
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.74
NVANORVALINEB,C1CA80.71
NVANORVALINEB,C,D1BA80.71
NVANORVALINEA1C9Y0.71
NVANORVALINEA,D2BTE0.71
NVANORVALINEA1OBH0.71
NVANORVALINEE,S1Z3P0.71
NVANORVALINEA1ZNM0.71
NVANORVALINEA1JDX0.71
NVANORVALINEA1FB50.71
NVANORVALINEA1OBC0.71
NVANORVALINE11YYY0.71
NVANORVALINEA,B1B6H0.71
NVANORVALINEA,B1ZZZ0.71
NVANORVALINEA,B,C2I6U0.71
NVANORVALINEB,C1BB00.71
NVANORVALINEE,S1Z3M0.71
VIG4-AMINO HEXANOIC ACIDA,B,C,D1OHW0.76
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.8
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.82
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.76
MLZN-METHYL-LYSINEA,B,I,J2PXJ0.7
MLZN-METHYL-LYSINEA,B,E,F1XQH0.7
MLZN-METHYL-LYSINEA,B,C,D2G460.7
MLZN-METHYL-LYSINED2B2V0.7
MLZN-METHYL-LYSINEA,B3CBM0.7
MLZN-METHYL-LYSINEA,B,C,D2OT70.7
MLZN-METHYL-LYSINEA,B,E,F3F9Y0.7
MLZN-METHYL-LYSINEP1Q3L0.7
MLZN-METHYL-LYSINEA,B,E,F2BQZ0.7
MLZN-METHYL-LYSINEA2RHY0.7
MLZN-METHYL-LYSINEA,B2F690.7
MLZN-METHYL-LYSINEA2R5A0.7
MLZN-METHYL-LYSINEA,B3F700.7
MLZN-METHYL-LYSINEA,B,C2H2J0.7
MLZN-METHYL-LYSINEC,D2H6K0.7
MLZN-METHYL-LYSINEA3EPQ0.7
MLZN-METHYL-LYSINEA,B2QNU0.7
MLZN-METHYL-LYSINEA,B,C,D3HHL0.7
MLZN-METHYL-LYSINEA1IV80.7
MLZN-METHYL-LYSINEA1XER0.7
MLZN-METHYL-LYSINEB,D2H9N0.7
MLZN-METHYL-LYSINEL2R5M0.7
MLZN-METHYL-LYSINEA3E3X0.7
MLZN-METHYL-LYSINEA,B2VYT0.7
MLZN-METHYL-LYSINEA,B,K,L1O9S0.7
MLZN-METHYL-LYSINEA,B,C1P0Y0.7
MLZN-METHYL-LYSINEA,B3CBO0.7
DNED-NORLEUCINEA1R9V0.78
DNED-NORLEUCINEA,B1S4A0.78
DNED-NORLEUCINEA,B1S1O0.78
H5MTRANS-3-HYDROXY-5-METHYLPROLINEA,B1A7Z0.7
NPI2-AMINOPIMELIC ACIDA2TDT0.71
NPI2-AMINOPIMELIC ACIDA1KGQ0.71
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
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.73
DAVDELTA-AMINO VALERIC ACIDA1H7O0.74
DAVDELTA-AMINO VALERIC ACIDA7JDW0.74
DO22-AMINO-6-OXO-HEXANOIC ACIDA,B1DJP0.75
MKE(4S)-4-AMINO-5-OXOHEXANOIC ACIDA,I2HAL0.75
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.73
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.73
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.74
ORNORNITHINEE1LAH0.73
ORNORNITHINEB,C,E,F,H,I,
K,L		1JDB0.73
ORNORNITHINEA,Y1TK20.73
ORNORNITHINEA,B,C2W6U0.73
ORNORNITHINEA1T5M0.73
ORNORNITHINEA,B,C,D,E,G,H1BXR0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1KEE0.73
ORNORNITHINEA,B,C1HQG0.73
ORNORNITHINEA,B,C2W6T0.73
ORNORNITHINEA,B1X7D0.73
ORNORNITHINEA1T5N0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1CE80.73
ORNORNITHINEA1DSR0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1A9X0.73
ORNORNITHINEH,K,L,M,P,R1N0X0.73
ORNORNITHINEA,B2PM50.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1CS00.73
ORNORNITHINEE,I1QR30.73
ORNORNITHINEA1HTH0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1M6V0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1C3O0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1C300.73
ORNORNITHINEA1XT70.73
ORNORNITHINEA3JDW0.73
ORNORNITHINEA,B,C,D,E,F,
G,H		1T360.73
ORNORNITHINEA,B1B2H0.73
ORNORNITHINEA,B,C,D,E,F4CEV0.73
NLENORLEUCINEA1MMT0.78
NLENORLEUCINEA,B1JB60.78
NLENORLEUCINEC1K2B0.78
NLENORLEUCINEA,B,C2AVQ0.78
NLENORLEUCINEC,D,I,L1R1L0.78
NLENORLEUCINEE,S2RLN0.78
NLENORLEUCINEE,S1Z3L0.78
NLENORLEUCINEA,B,C2AOD0.78
NLENORLEUCINEA,B,C2J9J0.78
NLENORLEUCINEA,B,I4HVP0.78
NLENORLEUCINEA,B,C2AVM0.78
NLENORLEUCINEB,C1K1T0.78
NLENORLEUCINEA,B,C2AOC0.78
NLENORLEUCINEA,B,C2JE40.78
NLENORLEUCINEA,B,I3DCK0.78
NLENORLEUCINEB1EOL0.78
NLENORLEUCINEA1FF00.78
NLENORLEUCINEA1FG60.78
NLENORLEUCINEA1FGC0.78
NLENORLEUCINEE,S1Z3M0.78
NLENORLEUCINEA2RME0.78
NLENORLEUCINEB1FGL0.78
NLENORLEUCINEC1K1U0.78
NLENORLEUCINEA,B1B7H0.78
NLENORLEUCINEA1HTH0.78
NLENORLEUCINEA,B,D2J9K0.78
NLENORLEUCINEA2RMD0.78
NLENORLEUCINEA,B,C2AOG0.78
NLENORLEUCINEA2RMI0.78
NLENORLEUCINEI1EPO0.78
NLENORLEUCINEA1FFI0.78
NLENORLEUCINEA1HD90.78
NLENORLEUCINEA1FFF0.78
NLENORLEUCINEB2JND0.78
NLENORLEUCINEA1FEJ0.78
NLENORLEUCINEA2K9E0.78
NLENORLEUCINEC1CFN0.78
NLENORLEUCINEC1K2C0.78
NLENORLEUCINEA1WY40.78
NLENORLEUCINEA1FQ80.78
NLENORLEUCINEA,B1S1O0.78
NLENORLEUCINEA2F4K0.78
NLENORLEUCINEA,B1D5E0.78
NLENORLEUCINEA2JX40.78
NLENORLEUCINEA1FG80.78
NLENORLEUCINEA1WY30.78
NLENORLEUCINEI1YTJ0.78
NLENORLEUCINEA,B,I3DCR0.78
NLENORLEUCINEA,I2O400.78
NLENORLEUCINEA,B2GYP0.78
NLENORLEUCINEC,F1A8K0.78
NLENORLEUCINEC1BAI0.78
NLENORLEUCINEA,B2JT90.78
NLENORLEUCINEA2RM90.78
NLENORLEUCINEA,B1DAZ0.78
NLENORLEUCINEA1F3R0.78
NLENORLEUCINEA,I2JXR0.78
NLENORLEUCINEC,F1A940.78
NLENORLEUCINEA,B1S4A0.78
NLENORLEUCINEA1R9V0.78
NLENORLEUCINEA,B,C,D,E,F2Z2T0.78