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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03098832

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2CG(1R,2R)-3-[(S)-amino(carboxy)methyl]cyclopropane-
1,2-dicarboxylic acid		A,B2E4V0.72
DGLD-GLUTAMIC ACIDA,B2JFX0.7
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.7
DGLD-GLUTAMIC ACIDA1C4B0.7
DGLD-GLUTAMIC ACIDA1CW80.7
DGLD-GLUTAMIC ACIDA,D1CZQ0.7
DGLD-GLUTAMIC ACIDA,B2JFY0.7
DGLD-GLUTAMIC ACIDI1QUR0.7
DGLD-GLUTAMIC ACIDA,D2Q3I0.7
DGLD-GLUTAMIC ACIDA1CVQ0.7
DGLD-GLUTAMIC ACIDA,B1P4N0.7
DGLD-GLUTAMIC ACIDA,B2VVT0.7
DGLD-GLUTAMIC ACIDE,S148L0.7
DGLD-GLUTAMIC ACIDA1KR60.7
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.7
DGLD-GLUTAMIC ACIDA1AY30.7
DGLD-GLUTAMIC ACIDA2J8F0.7
DGLD-GLUTAMIC ACIDU2AIZ0.7
DGLD-GLUTAMIC ACIDA,B,C2DWU0.7
DGLD-GLUTAMIC ACIDL2EAX0.7
DGLD-GLUTAMIC ACIDA,B2JFZ0.7
DGLD-GLUTAMIC ACIDH,I4THN0.7
DGLD-GLUTAMIC ACIDA1CWZ0.7
DGLD-GLUTAMIC ACIDP1MCK0.7
DGLD-GLUTAMIC ACIDA2JUE0.7
DGLD-GLUTAMIC ACIDA,B2JFO0.7
DGLD-GLUTAMIC ACIDA3H410.7
DGLD-GLUTAMIC ACIDA1D0K0.7
DGLD-GLUTAMIC ACIDL,N1WCO0.7
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.7
DGLD-GLUTAMIC ACIDH,I5GDS0.7
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.7
DGLD-GLUTAMIC ACIDA,B2JFQ0.7
DGLD-GLUTAMIC ACIDA,B2Q330.7
DGLD-GLUTAMIC ACIDA,B2JFP0.7
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.7
DGLD-GLUTAMIC ACIDA2J8G0.7
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.7
DMOALPHA-DIFLUOROMETHYLORNITHINEA,B,C,D2TOD0.73
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,B,C,D2APH0.75
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDB2FCI0.75
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA1B9U0.75
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,P1TWQ0.75
ORNORNITHINEE1LAH0.76
ORNORNITHINEB,C,E,F,H,I,
K,L		1JDB0.76
ORNORNITHINEA,Y1TK20.76
ORNORNITHINEA,B,C2W6U0.76
ORNORNITHINEA1T5M0.76
ORNORNITHINEA,B,C,D,E,G,H1BXR0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1KEE0.76
ORNORNITHINEA,B,C1HQG0.76
ORNORNITHINEA,B,C2W6T0.76
ORNORNITHINEA,B1X7D0.76
ORNORNITHINEA1T5N0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1CE80.76
ORNORNITHINEA1DSR0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1A9X0.76
ORNORNITHINEH,K,L,M,P,R1N0X0.76
ORNORNITHINEA,B2PM50.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1CS00.76
ORNORNITHINEE,I1QR30.76
ORNORNITHINEA1HTH0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1M6V0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1C3O0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1C300.76
ORNORNITHINEA1XT70.76
ORNORNITHINEA3JDW0.76
ORNORNITHINEA,B,C,D,E,F,
G,H		1T360.76
ORNORNITHINEA,B1B2H0.76
ORNORNITHINEA,B,C,D,E,F4CEV0.76
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.7
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.7
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.7
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.7
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.7
DLED-LEUCINEA,B1ALZ0.75
DLED-LEUCINEA,B1BDW0.75
DLED-LEUCINEA,D1CZQ0.75
DLED-LEUCINEA1BFW0.75
DLED-LEUCINEE,F,G,H1XN20.75
DLED-LEUCINEA,B,C,D1GMK0.75
DLED-LEUCINEA,B1TKQ0.75
DLED-LEUCINEA,B,C,H,K,L2R5D0.75
DLED-LEUCINEA2NPV0.75
DLED-LEUCINEA,B,C,D2R3C0.75
DLED-LEUCINEB,D,E1AFQ0.75
DLED-LEUCINEA,B1MIC0.75
DLED-LEUCINEA,B1NRU0.75
DLED-LEUCINEA,B1JNO0.75
DLED-LEUCINEA,B1GRM0.75
DLED-LEUCINEA,B1NRM0.75
DLED-LEUCINEA,D2Q3I0.75
DLED-LEUCINEA,B1NT50.75
DLED-LEUCINEA2JUE0.75
DLED-LEUCINEA,B,C,D1AV20.75
DLED-LEUCINEA1YY20.75
DLED-LEUCINEA,B1AL40.75
DLED-LEUCINEA,B1NG80.75
DLED-LEUCINEA,B1ALX0.75
DLED-LEUCINEA,B1JO40.75
DLED-LEUCINEA,B,C,H,K,L2R5B0.75
DLED-LEUCINEA,B1MAG0.75
DLED-LEUCINEA,B1NT60.75
DLED-LEUCINEA,B2Q330.75
DLED-LEUCINEA,B1JO30.75
DLED-LEUCINEE,I1BLL0.75
DLED-LEUCINEA,B1KQE0.75
DLED-LEUCINEA,B,C,D1W5U0.75
DLED-LEUCINEA,B,C,D2IZQ0.75
DLED-LEUCINEA1C4B0.75
DLED-LEUCINEA,B,C,D1C4D0.75
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
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
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.73
MN14-CARBOXYPIPERIDINEN1NLO0.73
MN14-CARBOXYPIPERIDINEN1NLP0.73
CPC2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACIDC,D193D0.7
ACA6-AMINOHEXANOIC ACIDA,B2JT90.76
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.76
ACA6-AMINOHEXANOIC ACIDC1ILP0.76
ACA6-AMINOHEXANOIC ACIDA2PK40.76
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.76
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		1VQ60.76
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.76
ACA6-AMINOHEXANOIC ACIDA1PK20.76
ACA6-AMINOHEXANOIC ACIDA2ZM70.76
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		3CMA0.76
ACA6-AMINOHEXANOIC ACIDC1ILQ0.76
ACA6-AMINOHEXANOIC ACIDA2ZM80.76
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		1VQK0.76
ACA6-AMINOHEXANOIC ACIDA2DCF0.76
ACA6-AMINOHEXANOIC ACIDA1HPK0.76
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		1VQ80.76
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		3CME0.76
ACA6-AMINOHEXANOIC ACIDA2ZM90.76
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		1VQN0.76
ACA6-AMINOHEXANOIC ACIDA2ZMA0.76
ACA6-AMINOHEXANOIC ACIDA3KIV0.76
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		1VQ90.76
DAVDELTA-AMINO VALERIC ACIDA1H7O0.85
DAVDELTA-AMINO VALERIC ACIDA7JDW0.85
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.7
VIG4-AMINO HEXANOIC ACIDA,B,C,D1OHW0.73
ABUGAMMA-AMINO-BUTANOIC ACIDE,I,J1M1A0.76
ABUGAMMA-AMINO-BUTANOIC ACIDD,I,J1M180.76
ABUGAMMA-AMINO-BUTANOIC ACIDA2OKK0.76
ABUGAMMA-AMINO-BUTANOIC ACIDI1QUR0.76
ABUGAMMA-AMINO-BUTANOIC ACIDE,I,J1M190.76
ABUGAMMA-AMINO-BUTANOIC ACIDA,B2OKJ0.76
ABUGAMMA-AMINO-BUTANOIC ACIDA,B1CGL0.76
ABUGAMMA-AMINO-BUTANOIC ACIDA6JDW0.76
ABUGAMMA-AMINO-BUTANOIC ACIDA,D,E,G,I,J1S320.76
ABUGAMMA-AMINO-BUTANOIC ACIDA,B2JT90.76
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.73
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.73
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.7
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.7
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.82
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.82
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.82
DGND-GLUTAMINEA,D2Q3I0.73
DGND-GLUTAMINEA,L1ZEA0.73
DGND-GLUTAMINEA,B2FCM0.73
DGND-GLUTAMINEA1BFW0.73
DGND-GLUTAMINEE1EPR0.73
DGND-GLUTAMINEA2JX40.73
DGND-GLUTAMINEA,B,C,D2R3C0.73
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.73
DGND-GLUTAMINEA,B2Q330.73
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.73
DGND-GLUTAMINEA,B,C1YJ10.73
DGND-GLUTAMINEA1B740.73
DILD-ISOLEUCINEA,B2Q330.75
DILD-ISOLEUCINEA1CWZ0.75
DILD-ISOLEUCINEA1CVQ0.75
DILD-ISOLEUCINEA1C4B0.75
DILD-ISOLEUCINEA1CW80.75
DILD-ISOLEUCINEA2AP80.75
IILISO-ISOLEUCINEA,B,C,D1Q4V0.75
IILISO-ISOLEUCINEA1KMF0.75
IILISO-ISOLEUCINEA,B,C1TGG0.75
IILISO-ISOLEUCINEA1RH40.75
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.73