MMsINC Database Search
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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02358590

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IILISO-ISOLEUCINEA,B,C,D1Q4V0.79
IILISO-ISOLEUCINEA1KMF0.79
IILISO-ISOLEUCINEA,B,C1TGG0.79
IILISO-ISOLEUCINEA1RH40.79
DILD-ISOLEUCINEA,B2Q330.79
DILD-ISOLEUCINEA1CWZ0.79
DILD-ISOLEUCINEA1CVQ0.79
DILD-ISOLEUCINEA1C4B0.79
DILD-ISOLEUCINEA1CW80.79
DILD-ISOLEUCINEA2AP80.79
DSGD-ASPARAGINEA,B2Q330.71
DSGD-ASPARAGINEA2IH00.71
DSGD-ASPARAGINEA2JUE0.71
DSGD-ASPARAGINEA1A850.71
DSGD-ASPARAGINEA1T5N0.71
DSGD-ASPARAGINEA2IGZ0.71
DSGD-ASPARAGINEA,B,C,D3BOG0.71
DSGD-ASPARAGINEA1T5M0.71
DSGD-ASPARAGINEA,B1HXB0.71
GAMALPHA-METHYL-L-GLUTAMIC ACIDA,B1BJO0.76
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.86
3MD2S,3S-3-METHYLASPARTIC ACIDA,B1KKR0.8
3MD2S,3S-3-METHYLASPARTIC ACIDA,B,C,D1I9C0.8
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
ASIL-ISO-ASPARTATEA1EJC0.75
ASIL-ISO-ASPARTATEA,B1EJD0.75
ASIL-ISO-ASPARTATEA,B,C,D1YBG0.75
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H
1RYW0.75
ASIL-ISO-ASPARTATEA,B,C,D2Z2C0.75
ASIL-ISO-ASPARTATEA,B,C,D1JG30.75
ASIL-ISO-ASPARTATEA,B1DLG0.75
ASIL-ISO-ASPARTATEA,B,C,D2HSE0.75
ASIL-ISO-ASPARTATEA1EYN0.75
ASIL-ISO-ASPARTATEA2JV00.75
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H,I,J,K,L,
W,X,Y,Z
1Q3G0.75
ILGGLUTAMYL GROUPA1EVC0.73
ILGGLUTAMYL GROUPA1XY50.73
ILGGLUTAMYL GROUPA1EVA0.73
ILGGLUTAMYL GROUPA1LCM0.73
ILGGLUTAMYL GROUPC,D2GSR0.73
ILGGLUTAMYL GROUPA1XY40.73
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQX0.73
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQW0.73
ILGGLUTAMYL GROUPA1EVB0.73
ILGGLUTAMYL GROUPA,B,C,D1I7Q0.73
ILGGLUTAMYL GROUPA,B1GAC0.73
ILGGLUTAMYL GROUPA1EVD0.73
ILGGLUTAMYL GROUPA,B,C,D1AQV0.73
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O900.74
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O930.74
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
A332-(carboxymethyl)-D-aspartic acidA,B3B3X0.84
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.73
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
FGA5-oxo-D-norvalineC,F,G,H3DW80.73
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYL0.73
FGA5-oxo-D-norvalineC,F,M,N2IAE0.73
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYM0.73
LED(4R)-5-OXO-L-LEUCINEA2IUW0.75
OHSO-(CARBOXYSULFANYL)-4-OXO-L-HOMOSERINEA,C1Y9A0.71
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
IMLN-METHYL-ISOLEUCINEC1CWM0.71
DGLD-GLUTAMIC ACIDA,B2JFX0.84
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.84
DGLD-GLUTAMIC ACIDA1C4B0.84
DGLD-GLUTAMIC ACIDA1CW80.84
DGLD-GLUTAMIC ACIDA,D1CZQ0.84
DGLD-GLUTAMIC ACIDA,B2JFY0.84
DGLD-GLUTAMIC ACIDI1QUR0.84
DGLD-GLUTAMIC ACIDA,D2Q3I0.84
DGLD-GLUTAMIC ACIDA1CVQ0.84
DGLD-GLUTAMIC ACIDA,B1P4N0.84
DGLD-GLUTAMIC ACIDA,B2VVT0.84
DGLD-GLUTAMIC ACIDE,S148L0.84
DGLD-GLUTAMIC ACIDA1KR60.84
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.84
DGLD-GLUTAMIC ACIDA1AY30.84
DGLD-GLUTAMIC ACIDA2J8F0.84
DGLD-GLUTAMIC ACIDU2AIZ0.84
DGLD-GLUTAMIC ACIDA,B,C2DWU0.84
DGLD-GLUTAMIC ACIDL2EAX0.84
DGLD-GLUTAMIC ACIDA,B2JFZ0.84
DGLD-GLUTAMIC ACIDH,I4THN0.84
DGLD-GLUTAMIC ACIDA1CWZ0.84
DGLD-GLUTAMIC ACIDP1MCK0.84
DGLD-GLUTAMIC ACIDA2JUE0.84
DGLD-GLUTAMIC ACIDA,B2JFO0.84
DGLD-GLUTAMIC ACIDA3H410.84
DGLD-GLUTAMIC ACIDA1D0K0.84
DGLD-GLUTAMIC ACIDL,N1WCO0.84
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.84
DGLD-GLUTAMIC ACIDH,I5GDS0.84
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.84
DGLD-GLUTAMIC ACIDA,B2JFQ0.84
DGLD-GLUTAMIC ACIDA,B2Q330.84
DGLD-GLUTAMIC ACIDA,B2JFP0.84
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.84
DGLD-GLUTAMIC ACIDA2J8G0.84
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.84
2AS(2S,3S)-3-amino-2-methyl-4-oxobutanoic acidA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.8
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
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1RTU0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1AT60.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FTL0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1DY50.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B2FTM0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI40.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI50.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1C9P0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1LSQ0.75
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.7
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.7
BIU5-bromo-L-isoleucineA3EDS0.72
DASD-ASPARTIC ACIDA1BFW0.75
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5D0.75
DASD-ASPARTIC ACIDA1KS70.75
DASD-ASPARTIC ACIDA1C4B0.75
DASD-ASPARTIC ACIDA,B,C,D3BOG0.75
DASD-ASPARTIC ACIDA,L1ZEA0.75
DASD-ASPARTIC ACIDA,B,C,D1HG10.75
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5B0.75
DASD-ASPARTIC ACIDA,B2Q330.75
DASD-ASPARTIC ACIDE1AN10.75
0A02-methyl-L-aspartic acidA1ART0.7
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.74
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.74
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q8H0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WV70.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2EC90.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,H,L,U2C4F0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2DPQ0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDL1PFX0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1Z6J0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AG70.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L,T2FIR0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONU0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZZU0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W2K0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WTG0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1TGG0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,I,L,T2B8O0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL10.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WQV0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2PF20.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHE0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WUN0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2AER0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONT0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WCT0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,G1IOD0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W0Y0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AWY0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L1DAN0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1VZM0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2AEI0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDG,L1NL00.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AD70.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZP00.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q3M0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J350.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1P0S0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHF0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZWL0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1CFI0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2O6N0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MTQ0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2A2Q0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J340.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WSS0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C,D1LQV0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MGX0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B2DPR0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2SPT0.82
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL20.82
DGND-GLUTAMINEA,D2Q3I0.7
DGND-GLUTAMINEA,L1ZEA0.7
DGND-GLUTAMINEA,B2FCM0.7
DGND-GLUTAMINEA1BFW0.7
DGND-GLUTAMINEE1EPR0.7
DGND-GLUTAMINEA2JX40.7
DGND-GLUTAMINEA,B,C,D2R3C0.7
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.7
DGND-GLUTAMINEA,B2Q330.7
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.7
DGND-GLUTAMINEA,B,C1YJ10.7
DGND-GLUTAMINEA1B740.7
B3D3-AMINOPENTANEDIOIC ACIDA,B,C2OXJ0.78
B3D3-AMINOPENTANEDIOIC ACIDA,B,C,D3C3F0.78
B3D3-AMINOPENTANEDIOIC ACIDA2OXK0.78
B3D3-AMINOPENTANEDIOIC ACIDA3C3G0.78
B3D3-AMINOPENTANEDIOIC ACIDA3C3H0.78
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.89
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.89
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
RGPGAMMA-GLUTAMYL PHOSPHATEA,B2J5V0.75
BFDASPARTATE BERYLLIUM TRIFLUORIDEA2JCM0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1J970.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2G070.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA1TA00.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B,C,D1RLO0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1ZDM0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA3EF10.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEE,F,G,H2FTK0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2HEG0.72
DMK3,3-DIMETHYL ASPARTIC ACIDE,F,G,H1NKK0.74
DMK3,3-DIMETHYL ASPARTIC ACIDA,B,C,D,E,F,
G,H
1NJT0.74
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.74
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.74
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.71
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.71
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.71
2CG(1R,2R)-3-[(S)-amino(carboxy)methyl]cyclopropane-
1,2-dicarboxylic acid
A,B2E4V0.8
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.81
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.81
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.81
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.89
ACB3-METHYL-ASPARTIC ACIDC,F,G,H3DW80.8
ACB3-METHYL-ASPARTIC ACIDA,B,C,D,E,F,
G,H
2NYL0.8
ACB3-METHYL-ASPARTIC ACIDA1EVD0.8
ACB3-METHYL-ASPARTIC ACIDA1EVB0.8
ACB3-METHYL-ASPARTIC ACIDA1EVA0.8
ACB3-METHYL-ASPARTIC ACIDA1LCM0.8
ACB3-METHYL-ASPARTIC ACIDA,B,C,D,E,F,
G,H
2NYM0.8
ACB3-METHYL-ASPARTIC ACIDA1AY30.8
ACB3-METHYL-ASPARTIC ACIDA,B,M,N1FJM0.8
ACB3-METHYL-ASPARTIC ACIDC,I2IE30.8
ACB3-METHYL-ASPARTIC ACIDC,F,X,Y2NPP0.8
ACB3-METHYL-ASPARTIC ACIDC,F,M,N2IAE0.8
ACB3-METHYL-ASPARTIC ACIDA1EVC0.8