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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03204613

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PSH1-thiophosphono-L-histidineA2R7C0.9
HIC4-METHYL-HISTIDINEA2Q970.95
HIC4-METHYL-HISTIDINEA1QZ60.95
HIC4-METHYL-HISTIDINEA3CHW0.95
HIC4-METHYL-HISTIDINEA,B2GWK0.95
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.95
HIC4-METHYL-HISTIDINEA2ASO0.95
HIC4-METHYL-HISTIDINEA,B2D1K0.95
HIC4-METHYL-HISTIDINEA,S1C0F0.95
HIC4-METHYL-HISTIDINEA,D1ATN0.95
HIC4-METHYL-HISTIDINEA,B2A420.95
HIC4-METHYL-HISTIDINEA,P2BTF0.95
HIC4-METHYL-HISTIDINEA,B1LOT0.95
HIC4-METHYL-HISTIDINEA1NWK0.95
HIC4-METHYL-HISTIDINEA,S1C0G0.95
HIC4-METHYL-HISTIDINEA,S1EQY0.95
HIC4-METHYL-HISTIDINEA2PAV0.95
HIC4-METHYL-HISTIDINEA2Q0U0.95
HIC4-METHYL-HISTIDINEA,B2HMP0.95
HIC4-METHYL-HISTIDINEA2PBD0.95
HIC4-METHYL-HISTIDINEA,S1DEJ0.95
HIC4-METHYL-HISTIDINEA,S1ESV0.95
HIC4-METHYL-HISTIDINEA1J6Z0.95
HIC4-METHYL-HISTIDINEA1WUA0.95
HIC4-METHYL-HISTIDINEA,B1YXQ0.95
HIC4-METHYL-HISTIDINEA1S220.95
HIC4-METHYL-HISTIDINEA,B,D,E2A400.95
HIC4-METHYL-HISTIDINEA1QZ50.95
HIC4-METHYL-HISTIDINEA2ZWH0.95
HIC4-METHYL-HISTIDINEA,B2A410.95
HIC4-METHYL-HISTIDINEB1MA90.95
HIC4-METHYL-HISTIDINEA,G3CI50.95
HIC4-METHYL-HISTIDINEA1Y640.95
HIC4-METHYL-HISTIDINEA,P1HLU0.95
HIC4-METHYL-HISTIDINEA,B2A3Z0.95
HIC4-METHYL-HISTIDINEA2FXU0.95
HIC4-METHYL-HISTIDINEA,G3CIP0.95
HIC4-METHYL-HISTIDINEA2GWJ0.95
HIC4-METHYL-HISTIDINEA,B2VCP0.95
HIAL-HISTIDINE AMIDEB1URL0.78
NEPN1-PHOSPHONOHISTIDINEA,B3FDZ0.91
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2NU60.91
NEPN1-PHOSPHONOHISTIDINEA1E580.91
NEPN1-PHOSPHONOHISTIDINEA,B1TIP0.91
NEPN1-PHOSPHONOHISTIDINEA,B2QE60.91
NEPN1-PHOSPHONOHISTIDINEA,B,C1WVQ0.91
NEPN1-PHOSPHONOHISTIDINEA,B2HHJ0.91
NEPN1-PHOSPHONOHISTIDINEA,B,D,E,F,G,
H,I
2NU90.91
NEPN1-PHOSPHONOHISTIDINEA,B1EUD0.91
NEPN1-PHOSPHONOHISTIDINEA,D1SCU0.91
NEPN1-PHOSPHONOHISTIDINEA,B2FPP0.91
NEPN1-PHOSPHONOHISTIDINEA,B2HWG0.91
NEPN1-PHOSPHONOHISTIDINEA,B1VSQ0.91
NEPN1-PHOSPHONOHISTIDINEA,B2FPI0.91
NEPN1-PHOSPHONOHISTIDINEA1QWO0.91
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2SCU0.91
NEPN1-PHOSPHONOHISTIDINEA,B2FP40.91
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.86
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.86
DHID-HISTIDINEP1MCB0.91
DHID-HISTIDINEA2EZ70.91
DHID-HISTIDINEP1MCN0.91
DHID-HISTIDINEA,D1CZQ0.91
DHID-HISTIDINEI1ER80.91
DHID-HISTIDINEP1MCL0.91
DHID-HISTIDINEA,B,C,D3BOG0.91
DHID-HISTIDINEA,L1ZEA0.91
WY2(6,7-DIHYDRO-5H-CYCLOPENTA[D]IMIDAZO[2,1-
B]THIAZOL-2-YL]-4,7-DIHYDRO[1,4]THIAZEPINE-
3,6-DICARBOXYLIC ACID
A1Q2P0.71
WY2(6,7-DIHYDRO-5H-CYCLOPENTA[D]IMIDAZO[2,1-
B]THIAZOL-2-YL]-4,7-DIHYDRO[1,4]THIAZEPINE-
3,6-DICARBOXYLIC ACID
A1Q2Q0.71
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.76
720(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL-
4-YL)METHYL]PENTANOIC ACID
A2JEW0.87
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.95
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.95
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.95
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.95
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.95
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.95
HIQ1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]-
L-HISTIDINE
A,B2IU40.94
XX5(S,S)-2-{1-CARBOXY-2-[3-(3,5-DICHLORO-
BENZYL)-3H-IMIDAZOL-4-YL]-ETHYLAMINO}-
4-METHYL-PENTANOIC ACID
A1R4L0.71
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.89
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.89
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.88
HIPND1-PHOSPHONOHISTIDINEA1NSP0.88
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.88
HIPND1-PHOSPHONOHISTIDINEA1PFH0.88
HIPND1-PHOSPHONOHISTIDINEA1JEM0.88
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.86
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1GEX0.77
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A,B,C,D1UU10.77
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1FG30.77
GI4METHYL ACETIC ACID-SUBSTITUTED GLUCOIMIDAZOLEA,B2J7G0.72
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.88
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.88
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
A1ONG0.7
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
A1ONH0.7
RIGARGADINA,B1W9U0.78
RIGARGADINA1WAW0.78
GI2METHYL ACETATE-SUBSTITUTED GLUCOIMIDAZOLEA,B2J7E0.71
HRBN-ACETYL-1-[(2R,3S,5R)-5-HYDROXY-
2-PENTYLTETRAHYDROFURAN-3-YL]-L-
HISTIDINE
H,L2DDQ0.81
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMN0.83
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A1EMF0.83
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMD0.83
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMO0.83
HSOHISTIDINOLA,B1H3J0.78
HSOHISTIDINOLA,B,C,D1KMN0.78
HSOHISTIDINOLA,B2FPU0.78
HSOHISTIDINOLA,B1KAE0.78
HSOHISTIDINOLN2BKD0.78
IIC4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHOREA1BFP0.82
MH11-methyl-L-histidineA,B3G880.95
MH11-methyl-L-histidineA,B3G890.95
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.95
XXY2-[(1R,2R)-1-amino-2-hydroxypropyl]-
1-(carboxymethyl)-4-(1H-imidazol-
5-ylmethyl)-1H-imidazol-5-olate
A2FWQ0.79
NZH(2S)-2-AMINO-3-[1-(1H-TETRAAZOL-
5-YL)-1H-IMIDAZOL-4-YL]PROPANAL
A1WVP0.75
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.89