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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03081884

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PF22-(4-{(3S,5S)-5-[(3,3-difluoropyrrolidin-
1-yl)carbonyl]pyrrolidin-3-yl}piperazin-
1-yl)pyrimidine
A,B3F8S0.71
HRBN-ACETYL-1-[(2R,3S,5R)-5-HYDROXY-
2-PENTYLTETRAHYDROFURAN-3-YL]-L-
HISTIDINE
H,L2DDQ0.72
HSOHISTIDINOLA,B1H3J0.8
HSOHISTIDINOLA,B,C,D1KMN0.8
HSOHISTIDINOLA,B2FPU0.8
HSOHISTIDINOLA,B1KAE0.8
HSOHISTIDINOLN2BKD0.8
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.73
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.73
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.73
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.73
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.73
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.73
DHID-HISTIDINEP1MCB0.75
DHID-HISTIDINEA2EZ70.75
DHID-HISTIDINEP1MCN0.75
DHID-HISTIDINEA,D1CZQ0.75
DHID-HISTIDINEI1ER80.75
DHID-HISTIDINEP1MCL0.75
DHID-HISTIDINEA,B,C,D3BOG0.75
DHID-HISTIDINEA,L1ZEA0.75
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.73
HIPND1-PHOSPHONOHISTIDINEA1NSP0.73
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.73
HIPND1-PHOSPHONOHISTIDINEA1PFH0.73
HIPND1-PHOSPHONOHISTIDINEA1JEM0.73
HIAL-HISTIDINE AMIDEB1URL0.84
HIC4-METHYL-HISTIDINEA2Q970.73
HIC4-METHYL-HISTIDINEA1QZ60.73
HIC4-METHYL-HISTIDINEA3CHW0.73
HIC4-METHYL-HISTIDINEA,B2GWK0.73
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.73
HIC4-METHYL-HISTIDINEA2ASO0.73
HIC4-METHYL-HISTIDINEA,B2D1K0.73
HIC4-METHYL-HISTIDINEA,S1C0F0.73
HIC4-METHYL-HISTIDINEA,D1ATN0.73
HIC4-METHYL-HISTIDINEA,B2A420.73
HIC4-METHYL-HISTIDINEA,P2BTF0.73
HIC4-METHYL-HISTIDINEA,B1LOT0.73
HIC4-METHYL-HISTIDINEA1NWK0.73
HIC4-METHYL-HISTIDINEA,S1C0G0.73
HIC4-METHYL-HISTIDINEA,S1EQY0.73
HIC4-METHYL-HISTIDINEA2PAV0.73
HIC4-METHYL-HISTIDINEA2Q0U0.73
HIC4-METHYL-HISTIDINEA,B2HMP0.73
HIC4-METHYL-HISTIDINEA2PBD0.73
HIC4-METHYL-HISTIDINEA,S1DEJ0.73
HIC4-METHYL-HISTIDINEA,S1ESV0.73
HIC4-METHYL-HISTIDINEA1J6Z0.73
HIC4-METHYL-HISTIDINEA1WUA0.73
HIC4-METHYL-HISTIDINEA,B1YXQ0.73
HIC4-METHYL-HISTIDINEA1S220.73
HIC4-METHYL-HISTIDINEA,B,D,E2A400.73
HIC4-METHYL-HISTIDINEA1QZ50.73
HIC4-METHYL-HISTIDINEA2ZWH0.73
HIC4-METHYL-HISTIDINEA,B2A410.73
HIC4-METHYL-HISTIDINEB1MA90.73
HIC4-METHYL-HISTIDINEA,G3CI50.73
HIC4-METHYL-HISTIDINEA1Y640.73
HIC4-METHYL-HISTIDINEA,P1HLU0.73
HIC4-METHYL-HISTIDINEA,B2A3Z0.73
HIC4-METHYL-HISTIDINEA2FXU0.73
HIC4-METHYL-HISTIDINEA,G3CIP0.73
HIC4-METHYL-HISTIDINEA2GWJ0.73
HIC4-METHYL-HISTIDINEA,B2VCP0.73
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.82
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
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
IIC4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHOREA1BFP0.81
NZH(2S)-2-AMINO-3-[1-(1H-TETRAAZOL-
5-YL)-1H-IMIDAZOL-4-YL]PROPANAL
A1WVP0.77
MH11-methyl-L-histidineA,B3G880.73
MH11-methyl-L-histidineA,B3G890.73
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.73
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.76
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.76
3AH[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL-
5-YL]-AMINE
A,B,C,D1DGH0.72
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.92
HIQ1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]-
L-HISTIDINE
A,B2IU40.7
XXY2-[(1R,2R)-1-amino-2-hydroxypropyl]-
1-(carboxymethyl)-4-(1H-imidazol-
5-ylmethyl)-1H-imidazol-5-olate
A2FWQ0.71
RIGARGADINA,B1W9U0.84
RIGARGADINA1WAW0.84
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.8
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.8
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.77