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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00547911

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.72
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.72
MH11-methyl-L-histidineA,B3G880.8
MH11-methyl-L-histidineA,B3G890.8
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.8
720(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL-
4-YL)METHYL]PENTANOIC ACID
A2JEW0.8
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.73
HIPND1-PHOSPHONOHISTIDINEA1NSP0.73
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.73
HIPND1-PHOSPHONOHISTIDINEA1PFH0.73
HIPND1-PHOSPHONOHISTIDINEA1JEM0.73
WY2(6,7-DIHYDRO-5H-CYCLOPENTA[D]IMIDAZO[2,1-
B]THIAZOL-2-YL]-4,7-DIHYDRO[1,4]THIAZEPINE-
3,6-DICARBOXYLIC ACID
A1Q2P0.87
WY2(6,7-DIHYDRO-5H-CYCLOPENTA[D]IMIDAZO[2,1-
B]THIAZOL-2-YL]-4,7-DIHYDRO[1,4]THIAZEPINE-
3,6-DICARBOXYLIC ACID
A1Q2Q0.87
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMN0.7
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A1EMF0.7
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMD0.7
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMO0.7
NEPN1-PHOSPHONOHISTIDINEA,B3FDZ0.75
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2NU60.75
NEPN1-PHOSPHONOHISTIDINEA1E580.75
NEPN1-PHOSPHONOHISTIDINEA,B1TIP0.75
NEPN1-PHOSPHONOHISTIDINEA,B2QE60.75
NEPN1-PHOSPHONOHISTIDINEA,B,C1WVQ0.75
NEPN1-PHOSPHONOHISTIDINEA,B2HHJ0.75
NEPN1-PHOSPHONOHISTIDINEA,B,D,E,F,G,
H,I
2NU90.75
NEPN1-PHOSPHONOHISTIDINEA,B1EUD0.75
NEPN1-PHOSPHONOHISTIDINEA,D1SCU0.75
NEPN1-PHOSPHONOHISTIDINEA,B2FPP0.75
NEPN1-PHOSPHONOHISTIDINEA,B2HWG0.75
NEPN1-PHOSPHONOHISTIDINEA,B1VSQ0.75
NEPN1-PHOSPHONOHISTIDINEA,B2FPI0.75
NEPN1-PHOSPHONOHISTIDINEA1QWO0.75
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2SCU0.75
NEPN1-PHOSPHONOHISTIDINEA,B2FP40.75
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.74
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.74
PSH1-thiophosphono-L-histidineA2R7C0.76
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.74
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.74
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.72
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.8
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.8
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.8
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.8
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.8
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.8
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.77
WY47-(5,6-DIHYDRO-8H-IMIDAZO[2,1-C][1,4]OXAZIN-
2-YL)-6-FORMYL-2,7-DIHYDRO- [1,4]THIAZEPINE-
3-CARBOXYLIC ACID
A1ONG0.73
WY47-(5,6-DIHYDRO-8H-IMIDAZO[2,1-C][1,4]OXAZIN-
2-YL)-6-FORMYL-2,7-DIHYDRO- [1,4]THIAZEPINE-
3-CARBOXYLIC ACID
A1ONH0.73
HIC4-METHYL-HISTIDINEA2Q970.8
HIC4-METHYL-HISTIDINEA1QZ60.8
HIC4-METHYL-HISTIDINEA3CHW0.8
HIC4-METHYL-HISTIDINEA,B2GWK0.8
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.8
HIC4-METHYL-HISTIDINEA2ASO0.8
HIC4-METHYL-HISTIDINEA,B2D1K0.8
HIC4-METHYL-HISTIDINEA,S1C0F0.8
HIC4-METHYL-HISTIDINEA,D1ATN0.8
HIC4-METHYL-HISTIDINEA,B2A420.8
HIC4-METHYL-HISTIDINEA,P2BTF0.8
HIC4-METHYL-HISTIDINEA,B1LOT0.8
HIC4-METHYL-HISTIDINEA1NWK0.8
HIC4-METHYL-HISTIDINEA,S1C0G0.8
HIC4-METHYL-HISTIDINEA,S1EQY0.8
HIC4-METHYL-HISTIDINEA2PAV0.8
HIC4-METHYL-HISTIDINEA2Q0U0.8
HIC4-METHYL-HISTIDINEA,B2HMP0.8
HIC4-METHYL-HISTIDINEA2PBD0.8
HIC4-METHYL-HISTIDINEA,S1DEJ0.8
HIC4-METHYL-HISTIDINEA,S1ESV0.8
HIC4-METHYL-HISTIDINEA1J6Z0.8
HIC4-METHYL-HISTIDINEA1WUA0.8
HIC4-METHYL-HISTIDINEA,B1YXQ0.8
HIC4-METHYL-HISTIDINEA1S220.8
HIC4-METHYL-HISTIDINEA,B,D,E2A400.8
HIC4-METHYL-HISTIDINEA1QZ50.8
HIC4-METHYL-HISTIDINEA2ZWH0.8
HIC4-METHYL-HISTIDINEA,B2A410.8
HIC4-METHYL-HISTIDINEB1MA90.8
HIC4-METHYL-HISTIDINEA,G3CI50.8
HIC4-METHYL-HISTIDINEA1Y640.8
HIC4-METHYL-HISTIDINEA,P1HLU0.8
HIC4-METHYL-HISTIDINEA,B2A3Z0.8
HIC4-METHYL-HISTIDINEA2FXU0.8
HIC4-METHYL-HISTIDINEA,G3CIP0.8
HIC4-METHYL-HISTIDINEA2GWJ0.8
HIC4-METHYL-HISTIDINEA,B2VCP0.8
DHID-HISTIDINEP1MCB0.76
DHID-HISTIDINEA2EZ70.76
DHID-HISTIDINEP1MCN0.76
DHID-HISTIDINEA,D1CZQ0.76
DHID-HISTIDINEI1ER80.76
DHID-HISTIDINEP1MCL0.76
DHID-HISTIDINEA,B,C,D3BOG0.76
DHID-HISTIDINEA,L1ZEA0.76
HIQ1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]-
L-HISTIDINE
A,B2IU40.77