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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02189562

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHID-HISTIDINEP1MCB0.84
DHID-HISTIDINEA2EZ70.84
DHID-HISTIDINEP1MCN0.84
DHID-HISTIDINEA,D1CZQ0.84
DHID-HISTIDINEI1ER80.84
DHID-HISTIDINEP1MCL0.84
DHID-HISTIDINEA,B,C,D3BOG0.84
DHID-HISTIDINEA,L1ZEA0.84
HIC4-METHYL-HISTIDINEA2Q970.78
HIC4-METHYL-HISTIDINEA1QZ60.78
HIC4-METHYL-HISTIDINEA3CHW0.78
HIC4-METHYL-HISTIDINEA,B2GWK0.78
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.78
HIC4-METHYL-HISTIDINEA2ASO0.78
HIC4-METHYL-HISTIDINEA,B2D1K0.78
HIC4-METHYL-HISTIDINEA,S1C0F0.78
HIC4-METHYL-HISTIDINEA,D1ATN0.78
HIC4-METHYL-HISTIDINEA,B2A420.78
HIC4-METHYL-HISTIDINEA,P2BTF0.78
HIC4-METHYL-HISTIDINEA,B1LOT0.78
HIC4-METHYL-HISTIDINEA1NWK0.78
HIC4-METHYL-HISTIDINEA,S1C0G0.78
HIC4-METHYL-HISTIDINEA,S1EQY0.78
HIC4-METHYL-HISTIDINEA2PAV0.78
HIC4-METHYL-HISTIDINEA2Q0U0.78
HIC4-METHYL-HISTIDINEA,B2HMP0.78
HIC4-METHYL-HISTIDINEA2PBD0.78
HIC4-METHYL-HISTIDINEA,S1DEJ0.78
HIC4-METHYL-HISTIDINEA,S1ESV0.78
HIC4-METHYL-HISTIDINEA1J6Z0.78
HIC4-METHYL-HISTIDINEA1WUA0.78
HIC4-METHYL-HISTIDINEA,B1YXQ0.78
HIC4-METHYL-HISTIDINEA1S220.78
HIC4-METHYL-HISTIDINEA,B,D,E2A400.78
HIC4-METHYL-HISTIDINEA1QZ50.78
HIC4-METHYL-HISTIDINEA2ZWH0.78
HIC4-METHYL-HISTIDINEA,B2A410.78
HIC4-METHYL-HISTIDINEB1MA90.78
HIC4-METHYL-HISTIDINEA,G3CI50.78
HIC4-METHYL-HISTIDINEA1Y640.78
HIC4-METHYL-HISTIDINEA,P1HLU0.78
HIC4-METHYL-HISTIDINEA,B2A3Z0.78
HIC4-METHYL-HISTIDINEA2FXU0.78
HIC4-METHYL-HISTIDINEA,G3CIP0.78
HIC4-METHYL-HISTIDINEA2GWJ0.78
HIC4-METHYL-HISTIDINEA,B2VCP0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.86
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.86
NEPN1-PHOSPHONOHISTIDINEA,B3FDZ0.77
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2NU60.77
NEPN1-PHOSPHONOHISTIDINEA1E580.77
NEPN1-PHOSPHONOHISTIDINEA,B1TIP0.77
NEPN1-PHOSPHONOHISTIDINEA,B2QE60.77
NEPN1-PHOSPHONOHISTIDINEA,B,C1WVQ0.77
NEPN1-PHOSPHONOHISTIDINEA,B2HHJ0.77
NEPN1-PHOSPHONOHISTIDINEA,B,D,E,F,G,
H,I
2NU90.77
NEPN1-PHOSPHONOHISTIDINEA,B1EUD0.77
NEPN1-PHOSPHONOHISTIDINEA,D1SCU0.77
NEPN1-PHOSPHONOHISTIDINEA,B2FPP0.77
NEPN1-PHOSPHONOHISTIDINEA,B2HWG0.77
NEPN1-PHOSPHONOHISTIDINEA,B1VSQ0.77
NEPN1-PHOSPHONOHISTIDINEA,B2FPI0.77
NEPN1-PHOSPHONOHISTIDINEA1QWO0.77
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2SCU0.77
NEPN1-PHOSPHONOHISTIDINEA,B2FP40.77
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.82
HRBN-ACETYL-1-[(2R,3S,5R)-5-HYDROXY-
2-PENTYLTETRAHYDROFURAN-3-YL]-L-
HISTIDINE
H,L2DDQ0.78
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.76
HIAL-HISTIDINE AMIDEB1URL0.84
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMN0.86
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A1EMF0.86
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMD0.86
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMO0.86
HSOHISTIDINOLA,B1H3J0.79
HSOHISTIDINOLA,B,C,D1KMN0.79
HSOHISTIDINOLA,B2FPU0.79
HSOHISTIDINOLA,B1KAE0.79
HSOHISTIDINOLN2BKD0.79
IIC4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHOREA1BFP0.84
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.78
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.78
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.78
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.78
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.78
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.78
720(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL-
4-YL)METHYL]PENTANOIC ACID
A2JEW0.74
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.81
HIPND1-PHOSPHONOHISTIDINEA1NSP0.81
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.81
HIPND1-PHOSPHONOHISTIDINEA1PFH0.81
HIPND1-PHOSPHONOHISTIDINEA1JEM0.81
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.81
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.81
LEHN-[12-(1H-imidazol-1-yl)dodecanoyl]-
L-leucine
A,B3BEN0.7
HIQ1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]-
L-HISTIDINE
A,B2IU40.78
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.75
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1GEX0.73
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A,B,C,D1UU10.73
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1FG30.73
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.89