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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03458880

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMN0.89
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A1EMF0.89
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMD0.89
CSH[2-(2-HYDROXY-1-METHYL-ETHYL)-4-
(1H-IMIDAZOL-4-YLMETHYL)-5-OXO-
IMIDAZOLIDIN-1-YL]-ACETIC ACID
A2EMO0.89
DHID-HISTIDINEP1MCB0.93
DHID-HISTIDINEA2EZ70.93
DHID-HISTIDINEP1MCN0.93
DHID-HISTIDINEA,D1CZQ0.93
DHID-HISTIDINEI1ER80.93
DHID-HISTIDINEP1MCL0.93
DHID-HISTIDINEA,B,C,D3BOG0.93
DHID-HISTIDINEA,L1ZEA0.93
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.91
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.91
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1GEX0.79
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A,B,C,D1UU10.79
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1FG30.79
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.87
GI4METHYL ACETIC ACID-SUBSTITUTED GLUCOIMIDAZOLEA,B2J7G0.71
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.91
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.91
720(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL-
4-YL)METHYL]PENTANOIC ACID
A2JEW0.8
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.81
GIRGIRODAZOLE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z
2OTL0.7
HIC4-METHYL-HISTIDINEA2Q970.87
HIC4-METHYL-HISTIDINEA1QZ60.87
HIC4-METHYL-HISTIDINEA3CHW0.87
HIC4-METHYL-HISTIDINEA,B2GWK0.87
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.87
HIC4-METHYL-HISTIDINEA2ASO0.87
HIC4-METHYL-HISTIDINEA,B2D1K0.87
HIC4-METHYL-HISTIDINEA,S1C0F0.87
HIC4-METHYL-HISTIDINEA,D1ATN0.87
HIC4-METHYL-HISTIDINEA,B2A420.87
HIC4-METHYL-HISTIDINEA,P2BTF0.87
HIC4-METHYL-HISTIDINEA,B1LOT0.87
HIC4-METHYL-HISTIDINEA1NWK0.87
HIC4-METHYL-HISTIDINEA,S1C0G0.87
HIC4-METHYL-HISTIDINEA,S1EQY0.87
HIC4-METHYL-HISTIDINEA2PAV0.87
HIC4-METHYL-HISTIDINEA2Q0U0.87
HIC4-METHYL-HISTIDINEA,B2HMP0.87
HIC4-METHYL-HISTIDINEA2PBD0.87
HIC4-METHYL-HISTIDINEA,S1DEJ0.87
HIC4-METHYL-HISTIDINEA,S1ESV0.87
HIC4-METHYL-HISTIDINEA1J6Z0.87
HIC4-METHYL-HISTIDINEA1WUA0.87
HIC4-METHYL-HISTIDINEA,B1YXQ0.87
HIC4-METHYL-HISTIDINEA1S220.87
HIC4-METHYL-HISTIDINEA,B,D,E2A400.87
HIC4-METHYL-HISTIDINEA1QZ50.87
HIC4-METHYL-HISTIDINEA2ZWH0.87
HIC4-METHYL-HISTIDINEA,B2A410.87
HIC4-METHYL-HISTIDINEB1MA90.87
HIC4-METHYL-HISTIDINEA,G3CI50.87
HIC4-METHYL-HISTIDINEA1Y640.87
HIC4-METHYL-HISTIDINEA,P1HLU0.87
HIC4-METHYL-HISTIDINEA,B2A3Z0.87
HIC4-METHYL-HISTIDINEA2FXU0.87
HIC4-METHYL-HISTIDINEA,G3CIP0.87
HIC4-METHYL-HISTIDINEA2GWJ0.87
HIC4-METHYL-HISTIDINEA,B2VCP0.87
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.91
HRBN-ACETYL-1-[(2R,3S,5R)-5-HYDROXY-
2-PENTYLTETRAHYDROFURAN-3-YL]-L-
HISTIDINE
H,L2DDQ0.79
HIQ1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]-
L-HISTIDINE
A,B2IU40.85
GI2METHYL ACETATE-SUBSTITUTED GLUCOIMIDAZOLEA,B2J7E0.71
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B,C,D2VVI0.72
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B,C,D1ZUX0.72
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B2DDD0.72
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B2DDC0.72
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B,C,D2VVH0.72
CR82-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-
1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-
2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-
5-OLATE
A,B2GW30.72
HAMHISTIDYL-ADENOSINE MONOPHOSPHATEA,B,C,D1ADY0.72
HAMHISTIDYL-ADENOSINE MONOPHOSPHATEA,B,C,D1KMM0.72
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.9
HIPND1-PHOSPHONOHISTIDINEA1NSP0.9
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.9
HIPND1-PHOSPHONOHISTIDINEA1PFH0.9
HIPND1-PHOSPHONOHISTIDINEA1JEM0.9
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.7
HIAL-HISTIDINE AMIDEB1URL0.82