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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03265614

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.72
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.72
2906-methyl-3,9-dihydro-2H-purin-2-
one
A,B,C,I,J,K3B9J0.73
4MZ4-METHYLIMIDAZOLEA1DTM0.87
4MZ4-METHYLIMIDAZOLEA,B1KEQ0.87
4MZ4-METHYLIMIDAZOLEA2FNN0.87
4MZ4-METHYLIMIDAZOLEA1MOO0.87
4MZ4-METHYLIMIDAZOLEA1G0E0.87
2BP9H-purin-2-amineA3G4M0.71
HIAL-HISTIDINE AMIDEB1URL0.78
1MZ1-METHYLIMIDAZOLEA1AET0.71
1MZ1-METHYLIMIDAZOLEA1LSX0.71
1MZ1-METHYLIMIDAZOLEA1DUO0.71
1MZ1-METHYLIMIDAZOLEA2H7R0.71
2MZ2-METHYLIMIDAZOLEA1AEU0.7
NVI1-VINYLIMIDAZOLEA,B2AFZ0.7
NVI1-VINYLIMIDAZOLEA1AEJ0.7
2EZ2-ETHYLIMIDAZOLEA1AEQ0.74
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.71
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
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.86
DHID-HISTIDINEP1MCB0.71
DHID-HISTIDINEA2EZ70.71
DHID-HISTIDINEP1MCN0.71
DHID-HISTIDINEA,D1CZQ0.71
DHID-HISTIDINEI1ER80.71
DHID-HISTIDINEP1MCL0.71
DHID-HISTIDINEA,B,C,D3BOG0.71
DHID-HISTIDINEA,L1ZEA0.71
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1GEX0.73
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A,B,C,D1UU10.73
HSAPHOSPHORIC ACID MONO-[2-AMINO-3-
(3H-IMIDAZOL-4-YL)-PROPYL]ESTER
A1FG30.73
IMDIMIDAZOLEA,B,C3H870.7
IMDIMIDAZOLEA1SQM0.7
IMDIMIDAZOLEA,B3CC10.7
IMDIMIDAZOLEA1AES0.7
IMDIMIDAZOLEA,B2HBA0.7
IMDIMIDAZOLEA,B3FVB0.7
IMDIMIDAZOLEA,B,C,D2QLE0.7
IMDIMIDAZOLEA2OD50.7
IMDIMIDAZOLEA,B2R4J0.7
IMDIMIDAZOLEA,B,C3FY40.7
IMDIMIDAZOLEA,B,C,D1I120.7
IMDIMIDAZOLEA1RUW0.7
IMDIMIDAZOLEA,B3GFF0.7
IMDIMIDAZOLEA,B,C,D1OUW0.7
IMDIMIDAZOLEA1PEE0.7
IMDIMIDAZOLEA,B2DDF0.7
IMDIMIDAZOLEX2AT30.7
IMDIMIDAZOLEA,B1R8E0.7
IMDIMIDAZOLEB,C,E,F1NU90.7
IMDIMIDAZOLEA,B3ECG0.7
IMDIMIDAZOLEA,B2R4E0.7
IMDIMIDAZOLEA1QPI0.7
IMDIMIDAZOLEA,B1HX30.7
IMDIMIDAZOLEA,B,C,D2Z3T0.7
IMDIMIDAZOLEA1L5N0.7
IMDIMIDAZOLEA,B2E2E0.7
IMDIMIDAZOLEA,C,H3F0Y0.7
IMDIMIDAZOLEA,B3D850.7
IMDIMIDAZOLEA1OD80.7
IMDIMIDAZOLET1Y590.7
IMDIMIDAZOLEX3B7U0.7
IMDIMIDAZOLEA1T8K0.7
IMDIMIDAZOLEA3C1J0.7
IMDIMIDAZOLEA2H7Q0.7
IMDIMIDAZOLEA,B1K6Z0.7
IMDIMIDAZOLEA,B,C,D,E,F,G1PZN0.7
IMDIMIDAZOLEA3EER0.7
IMDIMIDAZOLEA1DSO0.7
IMDIMIDAZOLEL1MRD0.7
IMDIMIDAZOLEA,B3EC00.7
IMDIMIDAZOLEA,B2W8X0.7
IMDIMIDAZOLEA1MUN0.7
IMDIMIDAZOLEA,B3C8L0.7
IMDIMIDAZOLEA1YXS0.7
IMDIMIDAZOLEA2NPJ0.7
IMDIMIDAZOLEL1MRC0.7
IMDIMIDAZOLEA2R5R0.7
IMDIMIDAZOLEA1IRC0.7
IMDIMIDAZOLEA2OBL0.7
IMDIMIDAZOLEA,B,C,D3C4E0.7
IMDIMIDAZOLEA3CHR0.7
IMDIMIDAZOLEA,B2ZQN0.7
IMDIMIDAZOLEX1PM10.7
IMDIMIDAZOLEA1V0M0.7
IMDIMIDAZOLEA2NPK0.7
IMDIMIDAZOLEO2G8C0.7
IMDIMIDAZOLEA2WCR0.7
IMDIMIDAZOLEA1CXA0.7
IMDIMIDAZOLEA,B,D1I1D0.7
IMDIMIDAZOLEA3D700.7
IMDIMIDAZOLEA3B7T0.7
IMDIMIDAZOLEA1MBI0.7
IMDIMIDAZOLEA,B,C,D3FCS0.7
IMDIMIDAZOLEA,B,C,D2ZC00.7
IMDIMIDAZOLEA1RKY0.7
IMDIMIDAZOLEA1V2G0.7
IMDIMIDAZOLEA,B,C,D3E490.7
IMDIMIDAZOLEA,B,C,D3HX80.7
IMDIMIDAZOLEA3CGX0.7
IMDIMIDAZOLEL3B7R0.7
IMDIMIDAZOLEA,B,C3DKQ0.7
IMDIMIDAZOLEA2DKK0.7
IMDIMIDAZOLEA,B,C,D1YXU0.7
IMDIMIDAZOLEH,J,L,N1OAU0.7
IMDIMIDAZOLEA2HVF0.7
IMDIMIDAZOLEA,B2V080.7
IMDIMIDAZOLEB,C,D1N1I0.7
IMDIMIDAZOLEA2PSD0.7
IMDIMIDAZOLEA1SXU0.7
IMDIMIDAZOLEA,B,C,D2GPE0.7
IMDIMIDAZOLEA1W7C0.7
IMDIMIDAZOLEA1NOC0.7
IMDIMIDAZOLEA,B3BR00.7
IMDIMIDAZOLEA3C1H0.7
IMDIMIDAZOLEA,B2OWQ0.7
IMDIMIDAZOLEA1HS60.7
IMDIMIDAZOLEA,B2HRC0.7
IMDIMIDAZOLEA3CHQ0.7
IMDIMIDAZOLEA1YXX0.7
IMDIMIDAZOLEA,B,C,D2RD90.7
IMDIMIDAZOLEA2UGI0.7
IMDIMIDAZOLEL1MRE0.7
IMDIMIDAZOLEC,D,G,H1NU70.7
IMDIMIDAZOLEA,B3C2Q0.7
IMDIMIDAZOLEA,B,C,D2G5F0.7
IMDIMIDAZOLEA1UUX0.7
IMDIMIDAZOLEA,B2VD30.7
IMDIMIDAZOLEA1UUY0.7
IMDIMIDAZOLEA4MBA0.7
IMDIMIDAZOLEA3HMZ0.7
IMDIMIDAZOLEA,C1HEZ0.7
IMDIMIDAZOLEA2NQC0.7
IMDIMIDAZOLEA3AKY0.7
IMDIMIDAZOLEA2OPC0.7
IMDIMIDAZOLEA3CHS0.7
IMDIMIDAZOLEA1WEG0.7
IMDIMIDAZOLEA3E2T0.7
IMDIMIDAZOLEA,C3G5O0.7
IMDIMIDAZOLEA2VZ50.7
IMDIMIDAZOLEA1H190.7
IMDIMIDAZOLEA1W8K0.7
IMDIMIDAZOLEA1DP90.7
IMDIMIDAZOLEA3CHP0.7
IMDIMIDAZOLEA,B2E180.7
IMDIMIDAZOLEA2O3P0.7
IMDIMIDAZOLEA2OH30.7
IMDIMIDAZOLEA3DEE0.7
IMDIMIDAZOLEA1DSP0.7
IMDIMIDAZOLET1Y5B0.7
IMDIMIDAZOLEL1MRF0.7
IMDIMIDAZOLEA2NOS0.7
IMDIMIDAZOLEA2NUH0.7
IMDIMIDAZOLEA2NOP0.7
IMDIMIDAZOLEA2PSE0.7
IMDIMIDAZOLEA1NMI0.7
IMDIMIDAZOLEA1DSG0.7
IMDIMIDAZOLEA,B,C,D1VDD0.7
IMDIMIDAZOLEA,B,C,D3EJ80.7
IMDIMIDAZOLEA,B2I6O0.7
IMDIMIDAZOLEA,B2VNQ0.7
IMDIMIDAZOLEA,B2GO30.7
IMDIMIDAZOLEA3GGD0.7
IMDIMIDAZOLEA1IKJ0.7
IMDIMIDAZOLEA2A0I0.7
IMDIMIDAZOLEA,B,C,D2QD10.7
IMDIMIDAZOLEA,B2R460.7
IMDIMIDAZOLEA1AKY0.7
IMDIMIDAZOLEA2VYO0.7
IMDIMIDAZOLEA,B1U170.7
IMDIMIDAZOLEA2C4W0.7
IMDIMIDAZOLEX2F5T0.7
IMDIMIDAZOLEA1GW60.7
IMDIMIDAZOLEA,B2R450.7
IMDIMIDAZOLEA1JRL0.7
IMDIMIDAZOLEA3D710.7
IMDIMIDAZOLEA,B2QD20.7
IMDIMIDAZOLEA2NPC0.7
IMDIMIDAZOLEA,B2QCU0.7
IMDIMIDAZOLEA,B2QZC0.7
IMDIMIDAZOLEA1NOS0.7
IMDIMIDAZOLEA,B,C,D1WWJ0.7
IMDIMIDAZOLEA2VJ80.7
IMDIMIDAZOLEA1W810.7
IMDIMIDAZOLEA,B2AH80.7
IMDIMIDAZOLET1Y5U0.7
IMDIMIDAZOLEA,B,C,D,E,F,
G,H,I,J,K,L
3E6Q0.7
IMDIMIDAZOLEA,B1KAE0.7
IMDIMIDAZOLEA1YWV0.7
IMDIMIDAZOLEA,B3EBZ0.7
IMDIMIDAZOLEA2NPD0.7
IMDIMIDAZOLEA1V0N0.7
IMDIMIDAZOLEA,B3VHB0.7
IMDIMIDAZOLEA1YXV0.7
IMDIMIDAZOLEX2ASN0.7
IMDIMIDAZOLEA,B2D6C0.7
IMDIMIDAZOLEA,B1WKQ0.7
IMDIMIDAZOLEA,B,C,D1GZ50.7
IMDIMIDAZOLEA,B,C1Y5E0.7
IMDIMIDAZOLEA2O630.7
IMDIMIDAZOLEA1DSE0.7
IMDIMIDAZOLEA,B3BQZ0.7
IMDIMIDAZOLEA,B,C,D,E,F2OGJ0.7
IMDIMIDAZOLEA1CCG0.7
IMDIMIDAZOLEA1DS40.7
IMDIMIDAZOLEA1U7R0.7
IMDIMIDAZOLEA1FI90.7
IMDIMIDAZOLEA,B3HDJ0.7
IMDIMIDAZOLEA,B1F4U0.7
IMDIMIDAZOLEA,B1L9E0.7
IMDIMIDAZOLEA1MUY0.7
IMDIMIDAZOLEA1FI70.7
IMDIMIDAZOLEA,B,C,D,E,F,
G,H
1UGI0.7
IMDIMIDAZOLEA,B,C,D2FMY0.7
IMDIMIDAZOLEA2O650.7
IMDIMIDAZOLEA,B2ZEG0.7
IMDIMIDAZOLEA2O640.7
IMDIMIDAZOLEA,B2ZQO0.7
IMDIMIDAZOLET1Y5A0.7
IMDIMIDAZOLEA2ZBX0.7
HSOHISTIDINOLA,B1H3J0.77
HSOHISTIDINOLA,B,C,D1KMN0.77
HSOHISTIDINOLA,B2FPU0.77
HSOHISTIDINOLA,B1KAE0.77
HSOHISTIDINOLN2BKD0.77