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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01738864

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HIAL-HISTIDINE AMIDEB1URL0.72
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.77
HSMHISTAMINEA,B1U180.83
HSMHISTAMINEA1AVN0.83
HSMHISTAMINEA,B1KAR0.83
HSMHISTAMINEA,B1NP10.83
HSMHISTAMINEA,B1JQD0.83
HSMHISTAMINEA,B2QEB0.83
HSMHISTAMINEA,B1QFV0.83
HSMHISTAMINEA1IKE0.83
HSMHISTAMINEA3BU10.83
HSMHISTAMINEA,B1QFT0.83
1MZ1-METHYLIMIDAZOLEA1AET0.76
1MZ1-METHYLIMIDAZOLEA1LSX0.76
1MZ1-METHYLIMIDAZOLEA1DUO0.76
1MZ1-METHYLIMIDAZOLEA2H7R0.76
4MZ4-METHYLIMIDAZOLEA1DTM0.9
4MZ4-METHYLIMIDAZOLEA,B1KEQ0.9
4MZ4-METHYLIMIDAZOLEA2FNN0.9
4MZ4-METHYLIMIDAZOLEA1MOO0.9
4MZ4-METHYLIMIDAZOLEA1G0E0.9
2EZ2-ETHYLIMIDAZOLEA1AEQ0.76
2MZ2-METHYLIMIDAZOLEA1AEU0.72
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CMP0.75
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CCI0.75
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
NVI1-VINYLIMIDAZOLEA,B2AFZ0.75
NVI1-VINYLIMIDAZOLEA1AEJ0.75
2801-methyl-1H-imidazole-5-carbaldehydeX2RBY0.71
2BP9H-purin-2-amineA3G4M0.75
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.77