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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03204515

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.77
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.77
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.72
NEPN1-PHOSPHONOHISTIDINEA,B3FDZ0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2NU60.7
NEPN1-PHOSPHONOHISTIDINEA1E580.7
NEPN1-PHOSPHONOHISTIDINEA,B1TIP0.7
NEPN1-PHOSPHONOHISTIDINEA,B2QE60.7
NEPN1-PHOSPHONOHISTIDINEA,B,C1WVQ0.7
NEPN1-PHOSPHONOHISTIDINEA,B2HHJ0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E,F,G,
H,I
2NU90.7
NEPN1-PHOSPHONOHISTIDINEA,B1EUD0.7
NEPN1-PHOSPHONOHISTIDINEA,D1SCU0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FPP0.7
NEPN1-PHOSPHONOHISTIDINEA,B2HWG0.7
NEPN1-PHOSPHONOHISTIDINEA,B1VSQ0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FPI0.7
NEPN1-PHOSPHONOHISTIDINEA1QWO0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2SCU0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FP40.7
4MZ4-METHYLIMIDAZOLEA1DTM0.87
4MZ4-METHYLIMIDAZOLEA,B1KEQ0.87
4MZ4-METHYLIMIDAZOLEA2FNN0.87
4MZ4-METHYLIMIDAZOLEA1MOO0.87
4MZ4-METHYLIMIDAZOLEA1G0E0.87
HIC4-METHYL-HISTIDINEA2Q970.72
HIC4-METHYL-HISTIDINEA1QZ60.72
HIC4-METHYL-HISTIDINEA3CHW0.72
HIC4-METHYL-HISTIDINEA,B2GWK0.72
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.72
HIC4-METHYL-HISTIDINEA2ASO0.72
HIC4-METHYL-HISTIDINEA,B2D1K0.72
HIC4-METHYL-HISTIDINEA,S1C0F0.72
HIC4-METHYL-HISTIDINEA,D1ATN0.72
HIC4-METHYL-HISTIDINEA,B2A420.72
HIC4-METHYL-HISTIDINEA,P2BTF0.72
HIC4-METHYL-HISTIDINEA,B1LOT0.72
HIC4-METHYL-HISTIDINEA1NWK0.72
HIC4-METHYL-HISTIDINEA,S1C0G0.72
HIC4-METHYL-HISTIDINEA,S1EQY0.72
HIC4-METHYL-HISTIDINEA2PAV0.72
HIC4-METHYL-HISTIDINEA2Q0U0.72
HIC4-METHYL-HISTIDINEA,B2HMP0.72
HIC4-METHYL-HISTIDINEA2PBD0.72
HIC4-METHYL-HISTIDINEA,S1DEJ0.72
HIC4-METHYL-HISTIDINEA,S1ESV0.72
HIC4-METHYL-HISTIDINEA1J6Z0.72
HIC4-METHYL-HISTIDINEA1WUA0.72
HIC4-METHYL-HISTIDINEA,B1YXQ0.72
HIC4-METHYL-HISTIDINEA1S220.72
HIC4-METHYL-HISTIDINEA,B,D,E2A400.72
HIC4-METHYL-HISTIDINEA1QZ50.72
HIC4-METHYL-HISTIDINEA2ZWH0.72
HIC4-METHYL-HISTIDINEA,B2A410.72
HIC4-METHYL-HISTIDINEB1MA90.72
HIC4-METHYL-HISTIDINEA,G3CI50.72
HIC4-METHYL-HISTIDINEA1Y640.72
HIC4-METHYL-HISTIDINEA,P1HLU0.72
HIC4-METHYL-HISTIDINEA,B2A3Z0.72
HIC4-METHYL-HISTIDINEA2FXU0.72
HIC4-METHYL-HISTIDINEA,G3CIP0.72
HIC4-METHYL-HISTIDINEA2GWJ0.72
HIC4-METHYL-HISTIDINEA,B2VCP0.72
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.71
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1GEX0.81
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A,B,C,D1UU10.81
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1FG30.81
1MZ1-METHYLIMIDAZOLEA1AET0.71
1MZ1-METHYLIMIDAZOLEA1LSX0.71
1MZ1-METHYLIMIDAZOLEA1DUO0.71
1MZ1-METHYLIMIDAZOLEA2H7R0.71
HIAL-HISTIDINE AMIDEB1URL0.86
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.72
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.72
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.72
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.72
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.72
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.72
2MZ2-METHYLIMIDAZOLEA1AEU0.7
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.74
HIPND1-PHOSPHONOHISTIDINEA1NSP0.74
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.74
HIPND1-PHOSPHONOHISTIDINEA1PFH0.74
HIPND1-PHOSPHONOHISTIDINEA1JEM0.74
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
PIM4-PHENYL-1H-IMIDAZOLEA,B2D0T0.71
PIM4-PHENYL-1H-IMIDAZOLEA1E9X0.71
PIM4-PHENYL-1H-IMIDAZOLEA1PHD0.71
PIM4-PHENYL-1H-IMIDAZOLEA,B,C,D2RFC0.71
PIM4-PHENYL-1H-IMIDAZOLEA1ODO0.71
PIM4-PHENYL-1H-IMIDAZOLEA3E5K0.71
PIM4-PHENYL-1H-IMIDAZOLEA1PHE0.71
PIM4-PHENYL-1H-IMIDAZOLEA,B1F4T0.71
PIM4-PHENYL-1H-IMIDAZOLEA1S1F0.71
PIM4-PHENYL-1H-IMIDAZOLEA1PHF0.71
DHID-HISTIDINEP1MCB0.78
DHID-HISTIDINEA2EZ70.78
DHID-HISTIDINEP1MCN0.78
DHID-HISTIDINEA,D1CZQ0.78
DHID-HISTIDINEI1ER80.78
DHID-HISTIDINEP1MCL0.78
DHID-HISTIDINEA,B,C,D3BOG0.78
DHID-HISTIDINEA,L1ZEA0.78
GIRGIRODAZOLE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z
2OTL0.78
CHQCYCLO-(L-HISTIDINE-L-PROLINE) INHIBITORA,B1W1T0.75
HSOHISTIDINOLA,B1H3J0.85
HSOHISTIDINOLA,B,C,D1KMN0.85
HSOHISTIDINOLA,B2FPU0.85
HSOHISTIDINOLA,B1KAE0.85
HSOHISTIDINOLN2BKD0.85
IIC4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHOREA1BFP0.71
2EZ2-ETHYLIMIDAZOLEA1AEQ0.74
NVI1-VINYLIMIDAZOLEA,B2AFZ0.72
NVI1-VINYLIMIDAZOLEA1AEJ0.72
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.84
HSMHISTAMINEA,B1U180.93
HSMHISTAMINEA1AVN0.93
HSMHISTAMINEA,B1KAR0.93
HSMHISTAMINEA,B1NP10.93
HSMHISTAMINEA,B1JQD0.93
HSMHISTAMINEA,B2QEB0.93
HSMHISTAMINEA,B1QFV0.93
HSMHISTAMINEA1IKE0.93
HSMHISTAMINEA3BU10.93
HSMHISTAMINEA,B1QFT0.93
IMDIMIDAZOLEA,B,C3H870.72
IMDIMIDAZOLEA1SQM0.72
IMDIMIDAZOLEA,B3CC10.72
IMDIMIDAZOLEA1AES0.72
IMDIMIDAZOLEA,B2HBA0.72
IMDIMIDAZOLEA,B3FVB0.72
IMDIMIDAZOLEA,B,C,D2QLE0.72
IMDIMIDAZOLEA2OD50.72
IMDIMIDAZOLEA,B2R4J0.72
IMDIMIDAZOLEA,B,C3FY40.72
IMDIMIDAZOLEA,B,C,D1I120.72
IMDIMIDAZOLEA1RUW0.72
IMDIMIDAZOLEA,B3GFF0.72
IMDIMIDAZOLEA,B,C,D1OUW0.72
IMDIMIDAZOLEA1PEE0.72
IMDIMIDAZOLEA,B2DDF0.72
IMDIMIDAZOLEX2AT30.72
IMDIMIDAZOLEA,B1R8E0.72
IMDIMIDAZOLEB,C,E,F1NU90.72
IMDIMIDAZOLEA,B3ECG0.72
IMDIMIDAZOLEA,B2R4E0.72
IMDIMIDAZOLEA1QPI0.72
IMDIMIDAZOLEA,B1HX30.72
IMDIMIDAZOLEA,B,C,D2Z3T0.72
IMDIMIDAZOLEA1L5N0.72
IMDIMIDAZOLEA,B2E2E0.72
IMDIMIDAZOLEA,C,H3F0Y0.72
IMDIMIDAZOLEA,B3D850.72
IMDIMIDAZOLEA1OD80.72
IMDIMIDAZOLET1Y590.72
IMDIMIDAZOLEX3B7U0.72
IMDIMIDAZOLEA1T8K0.72
IMDIMIDAZOLEA3C1J0.72
IMDIMIDAZOLEA2H7Q0.72
IMDIMIDAZOLEA,B1K6Z0.72
IMDIMIDAZOLEA,B,C,D,E,F,G1PZN0.72
IMDIMIDAZOLEA3EER0.72
IMDIMIDAZOLEA1DSO0.72
IMDIMIDAZOLEL1MRD0.72
IMDIMIDAZOLEA,B3EC00.72
IMDIMIDAZOLEA,B2W8X0.72
IMDIMIDAZOLEA1MUN0.72
IMDIMIDAZOLEA,B3C8L0.72
IMDIMIDAZOLEA1YXS0.72
IMDIMIDAZOLEA2NPJ0.72
IMDIMIDAZOLEL1MRC0.72
IMDIMIDAZOLEA2R5R0.72
IMDIMIDAZOLEA1IRC0.72
IMDIMIDAZOLEA2OBL0.72
IMDIMIDAZOLEA,B,C,D3C4E0.72
IMDIMIDAZOLEA3CHR0.72
IMDIMIDAZOLEA,B2ZQN0.72
IMDIMIDAZOLEX1PM10.72
IMDIMIDAZOLEA1V0M0.72
IMDIMIDAZOLEA2NPK0.72
IMDIMIDAZOLEO2G8C0.72
IMDIMIDAZOLEA2WCR0.72
IMDIMIDAZOLEA1CXA0.72
IMDIMIDAZOLEA,B,D1I1D0.72
IMDIMIDAZOLEA3D700.72
IMDIMIDAZOLEA3B7T0.72
IMDIMIDAZOLEA1MBI0.72
IMDIMIDAZOLEA,B,C,D3FCS0.72
IMDIMIDAZOLEA,B,C,D2ZC00.72
IMDIMIDAZOLEA1RKY0.72
IMDIMIDAZOLEA1V2G0.72
IMDIMIDAZOLEA,B,C,D3E490.72
IMDIMIDAZOLEA,B,C,D3HX80.72
IMDIMIDAZOLEA3CGX0.72
IMDIMIDAZOLEL3B7R0.72
IMDIMIDAZOLEA,B,C3DKQ0.72
IMDIMIDAZOLEA2DKK0.72
IMDIMIDAZOLEA,B,C,D1YXU0.72
IMDIMIDAZOLEH,J,L,N1OAU0.72
IMDIMIDAZOLEA2HVF0.72
IMDIMIDAZOLEA,B2V080.72
IMDIMIDAZOLEB,C,D1N1I0.72
IMDIMIDAZOLEA2PSD0.72
IMDIMIDAZOLEA1SXU0.72
IMDIMIDAZOLEA,B,C,D2GPE0.72
IMDIMIDAZOLEA1W7C0.72
IMDIMIDAZOLEA1NOC0.72
IMDIMIDAZOLEA,B3BR00.72
IMDIMIDAZOLEA3C1H0.72
IMDIMIDAZOLEA,B2OWQ0.72
IMDIMIDAZOLEA1HS60.72
IMDIMIDAZOLEA,B2HRC0.72
IMDIMIDAZOLEA3CHQ0.72
IMDIMIDAZOLEA1YXX0.72
IMDIMIDAZOLEA,B,C,D2RD90.72
IMDIMIDAZOLEA2UGI0.72
IMDIMIDAZOLEL1MRE0.72
IMDIMIDAZOLEC,D,G,H1NU70.72
IMDIMIDAZOLEA,B3C2Q0.72
IMDIMIDAZOLEA,B,C,D2G5F0.72
IMDIMIDAZOLEA1UUX0.72
IMDIMIDAZOLEA,B2VD30.72
IMDIMIDAZOLEA1UUY0.72
IMDIMIDAZOLEA4MBA0.72
IMDIMIDAZOLEA3HMZ0.72
IMDIMIDAZOLEA,C1HEZ0.72
IMDIMIDAZOLEA2NQC0.72
IMDIMIDAZOLEA3AKY0.72
IMDIMIDAZOLEA2OPC0.72
IMDIMIDAZOLEA3CHS0.72
IMDIMIDAZOLEA1WEG0.72
IMDIMIDAZOLEA3E2T0.72
IMDIMIDAZOLEA,C3G5O0.72
IMDIMIDAZOLEA2VZ50.72
IMDIMIDAZOLEA1H190.72
IMDIMIDAZOLEA1W8K0.72
IMDIMIDAZOLEA1DP90.72
IMDIMIDAZOLEA3CHP0.72
IMDIMIDAZOLEA,B2E180.72
IMDIMIDAZOLEA2O3P0.72
IMDIMIDAZOLEA2OH30.72
IMDIMIDAZOLEA3DEE0.72
IMDIMIDAZOLEA1DSP0.72
IMDIMIDAZOLET1Y5B0.72
IMDIMIDAZOLEL1MRF0.72
IMDIMIDAZOLEA2NOS0.72
IMDIMIDAZOLEA2NUH0.72
IMDIMIDAZOLEA2NOP0.72
IMDIMIDAZOLEA2PSE0.72
IMDIMIDAZOLEA1NMI0.72
IMDIMIDAZOLEA1DSG0.72
IMDIMIDAZOLEA,B,C,D1VDD0.72
IMDIMIDAZOLEA,B,C,D3EJ80.72
IMDIMIDAZOLEA,B2I6O0.72
IMDIMIDAZOLEA,B2VNQ0.72
IMDIMIDAZOLEA,B2GO30.72
IMDIMIDAZOLEA3GGD0.72
IMDIMIDAZOLEA1IKJ0.72
IMDIMIDAZOLEA2A0I0.72
IMDIMIDAZOLEA,B,C,D2QD10.72
IMDIMIDAZOLEA,B2R460.72
IMDIMIDAZOLEA1AKY0.72
IMDIMIDAZOLEA2VYO0.72
IMDIMIDAZOLEA,B1U170.72
IMDIMIDAZOLEA2C4W0.72
IMDIMIDAZOLEX2F5T0.72
IMDIMIDAZOLEA1GW60.72
IMDIMIDAZOLEA,B2R450.72
IMDIMIDAZOLEA1JRL0.72
IMDIMIDAZOLEA3D710.72
IMDIMIDAZOLEA,B2QD20.72
IMDIMIDAZOLEA2NPC0.72
IMDIMIDAZOLEA,B2QCU0.72
IMDIMIDAZOLEA,B2QZC0.72
IMDIMIDAZOLEA1NOS0.72
IMDIMIDAZOLEA,B,C,D1WWJ0.72
IMDIMIDAZOLEA2VJ80.72
IMDIMIDAZOLEA1W810.72
IMDIMIDAZOLEA,B2AH80.72
IMDIMIDAZOLET1Y5U0.72
IMDIMIDAZOLEA,B,C,D,E,F,
G,H,I,J,K,L
3E6Q0.72
IMDIMIDAZOLEA,B1KAE0.72
IMDIMIDAZOLEA1YWV0.72
IMDIMIDAZOLEA,B3EBZ0.72
IMDIMIDAZOLEA2NPD0.72
IMDIMIDAZOLEA1V0N0.72
IMDIMIDAZOLEA,B3VHB0.72
IMDIMIDAZOLEA1YXV0.72
IMDIMIDAZOLEX2ASN0.72
IMDIMIDAZOLEA,B2D6C0.72
IMDIMIDAZOLEA,B1WKQ0.72
IMDIMIDAZOLEA,B,C,D1GZ50.72
IMDIMIDAZOLEA,B,C1Y5E0.72
IMDIMIDAZOLEA2O630.72
IMDIMIDAZOLEA1DSE0.72
IMDIMIDAZOLEA,B3BQZ0.72
IMDIMIDAZOLEA,B,C,D,E,F2OGJ0.72
IMDIMIDAZOLEA1CCG0.72
IMDIMIDAZOLEA1DS40.72
IMDIMIDAZOLEA1U7R0.72
IMDIMIDAZOLEA1FI90.72
IMDIMIDAZOLEA,B3HDJ0.72
IMDIMIDAZOLEA,B1F4U0.72
IMDIMIDAZOLEA,B1L9E0.72
IMDIMIDAZOLEA1MUY0.72
IMDIMIDAZOLEA1FI70.72
IMDIMIDAZOLEA,B,C,D,E,F,
G,H
1UGI0.72
IMDIMIDAZOLEA,B,C,D2FMY0.72
IMDIMIDAZOLEA2O650.72
IMDIMIDAZOLEA,B2ZEG0.72
IMDIMIDAZOLEA2O640.72
IMDIMIDAZOLEA,B2ZQO0.72
IMDIMIDAZOLET1Y5A0.72
IMDIMIDAZOLEA2ZBX0.72
MH11-methyl-L-histidineA,B3G880.72
MH11-methyl-L-histidineA,B3G890.72
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.72
2906-methyl-3,9-dihydro-2H-purin-2-
one
A,B,C,I,J,K3B9J0.71
NZH(2S)-2-AMINO-3-[1-(1H-TETRAAZOL-
5-YL)-1H-IMIDAZOL-4-YL]PROPANAL
A1WVP0.74