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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00485077

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HP1IMIDAZOLE-PYRROLE-HYDROXYPYRROLE POLYAMIDEA,B407D0.7
DHID-HISTIDINEP1MCB0.74
DHID-HISTIDINEA2EZ70.74
DHID-HISTIDINEP1MCN0.74
DHID-HISTIDINEA,D1CZQ0.74
DHID-HISTIDINEI1ER80.74
DHID-HISTIDINEP1MCL0.74
DHID-HISTIDINEA,B,C,D3BOG0.74
DHID-HISTIDINEA,L1ZEA0.74
ILTMONOIMIDAZOLE LEXITROPSINA1LEY0.71
ILTMONOIMIDAZOLE LEXITROPSINB1LEX0.71
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.78
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.78
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.72
HIPND1-PHOSPHONOHISTIDINEA1NSP0.72
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.72
HIPND1-PHOSPHONOHISTIDINEA1PFH0.72
HIPND1-PHOSPHONOHISTIDINEA1JEM0.72
HRBN-ACETYL-1-[(2R,3S,5R)-5-HYDROXY-
2-PENTYLTETRAHYDROFURAN-3-YL]-L-
HISTIDINE
H,L2DDQ0.7
NZH(2S)-2-AMINO-3-[1-(1H-TETRAAZOL-
5-YL)-1H-IMIDAZOL-4-YL]PROPANAL
A1WVP0.76
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.87
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.74
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.74
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.73
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.73
MH11-methyl-L-histidineA,B3G880.71
MH11-methyl-L-histidineA,B3G890.71
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.71
IIC4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHOREA1BFP0.81
PF22-(4-{(3S,5S)-5-[(3,3-difluoropyrrolidin-
1-yl)carbonyl]pyrrolidin-3-yl}piperazin-
1-yl)pyrimidine
A,B3F8S0.7
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.75
RIGARGADINA,B1W9U0.78
RIGARGADINA1WAW0.78
HIC4-METHYL-HISTIDINEA2Q970.71
HIC4-METHYL-HISTIDINEA1QZ60.71
HIC4-METHYL-HISTIDINEA3CHW0.71
HIC4-METHYL-HISTIDINEA,B2GWK0.71
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.71
HIC4-METHYL-HISTIDINEA2ASO0.71
HIC4-METHYL-HISTIDINEA,B2D1K0.71
HIC4-METHYL-HISTIDINEA,S1C0F0.71
HIC4-METHYL-HISTIDINEA,D1ATN0.71
HIC4-METHYL-HISTIDINEA,B2A420.71
HIC4-METHYL-HISTIDINEA,P2BTF0.71
HIC4-METHYL-HISTIDINEA,B1LOT0.71
HIC4-METHYL-HISTIDINEA1NWK0.71
HIC4-METHYL-HISTIDINEA,S1C0G0.71
HIC4-METHYL-HISTIDINEA,S1EQY0.71
HIC4-METHYL-HISTIDINEA2PAV0.71
HIC4-METHYL-HISTIDINEA2Q0U0.71
HIC4-METHYL-HISTIDINEA,B2HMP0.71
HIC4-METHYL-HISTIDINEA2PBD0.71
HIC4-METHYL-HISTIDINEA,S1DEJ0.71
HIC4-METHYL-HISTIDINEA,S1ESV0.71
HIC4-METHYL-HISTIDINEA1J6Z0.71
HIC4-METHYL-HISTIDINEA1WUA0.71
HIC4-METHYL-HISTIDINEA,B1YXQ0.71
HIC4-METHYL-HISTIDINEA1S220.71
HIC4-METHYL-HISTIDINEA,B,D,E2A400.71
HIC4-METHYL-HISTIDINEA1QZ50.71
HIC4-METHYL-HISTIDINEA2ZWH0.71
HIC4-METHYL-HISTIDINEA,B2A410.71
HIC4-METHYL-HISTIDINEB1MA90.71
HIC4-METHYL-HISTIDINEA,G3CI50.71
HIC4-METHYL-HISTIDINEA1Y640.71
HIC4-METHYL-HISTIDINEA,P1HLU0.71
HIC4-METHYL-HISTIDINEA,B2A3Z0.71
HIC4-METHYL-HISTIDINEA2FXU0.71
HIC4-METHYL-HISTIDINEA,G3CIP0.71
HIC4-METHYL-HISTIDINEA2GWJ0.71
HIC4-METHYL-HISTIDINEA,B2VCP0.71
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.78
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
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.72
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,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
HSOHISTIDINOLA,B1H3J0.78
HSOHISTIDINOLA,B,C,D1KMN0.78
HSOHISTIDINOLA,B2FPU0.78
HSOHISTIDINOLA,B1KAE0.78
HSOHISTIDINOLN2BKD0.78
HIAL-HISTIDINE AMIDEB1URL0.83
CRG[2-(1-AMINO-2-HYDROXY-PROPYL)-4-
(3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO-
4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID
A1KYS0.7
CRG[2-(1-AMINO-2-HYDROXY-PROPYL)-4-
(3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO-
4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID
A1KYR0.7
CRG[2-(1-AMINO-2-HYDROXY-PROPYL)-4-
(3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO-
4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID
A1KYP0.7
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.71
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.71
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.71