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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02162737

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2MZ2-METHYLIMIDAZOLEA1AEU0.73
ADEADENINEA1WEI0.7
ADEADENINEA2QLU0.7
ADEADENINEA,B2H8G0.7
ADEADENINEA,B1HQC0.7
ADEADENINEA1AHA0.7
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.7
ADEADENINEA,B,D1YXM0.7
ADEADENINEA1CB00.7
ADEADENINEA,B2QTT0.7
ADEADENINEA,B,C1XE80.7
ADEADENINEA,B1M2T0.7
ADEADENINEA2P8N0.7
ADEADENINEA,B,C2PQJ0.7
ADEADENINEA,B,C1VRL0.7
ADEADENINEA,B3BSF0.7
ADEADENINEX1Y260.7
ADEADENINEA,B1ZN70.7
ADEADENINEA,B1Z5N0.7
ADEADENINEA1QB70.7
ADEADENINEA1LU10.7
ADEADENINEA,B1Q8Y0.7
ADEADENINEA2QES0.7
ADEADENINEA2PUB0.7
ADEADENINEA1Z8D0.7
ADEADENINEA1JH80.7
ADEADENINEA1QD20.7
ADEADENINEA2ICS0.7
ADEADENINEA1IFS0.7
ADEADENINEA1NLI0.7
ADEADENINEA,B1D2A0.7
ADEADENINEA1GIU0.7
ADEADENINEA1J1R0.7
ADEADENINEA2QET0.7
ADEADENINEA,B,C1OD40.7
ADEADENINEA,B1QCI0.7
ADEADENINEA,B,C,D,E,F2GA40.7
ADEADENINEA,B1JYS0.7
ADEADENINEA1LPD0.7
ADEADENINEA,B1OD20.7
ADEADENINEA1WTA0.7
ADEADENINEA,B,C1S2D0.7
ADEADENINEA1MUD0.7
ADEADENINEA2PUE0.7
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.73
301N6-(penta-2,3-dienyl)adenineA3BW70.72
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CMP0.76
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CCI0.76
HSMHISTAMINEA,B1U180.87
HSMHISTAMINEA1AVN0.87
HSMHISTAMINEA,B1KAR0.87
HSMHISTAMINEA,B1NP10.87
HSMHISTAMINEA,B1JQD0.87
HSMHISTAMINEA,B2QEB0.87
HSMHISTAMINEA,B1QFV0.87
HSMHISTAMINEA1IKE0.87
HSMHISTAMINEA3BU10.87
HSMHISTAMINEA,B1QFT0.87
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.81
M1A6-AMINO-1-METHYLPURINEA1B420.74
3MA6-AMINO-3-METHYLPURINEA3MAG0.74
HIAL-HISTIDINE AMIDEB1URL0.73
2801-methyl-1H-imidazole-5-carbaldehydeX2RBY0.72
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine
A,B2W6Z0.72
2BP9H-purin-2-amineA3G4M0.78
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A1W1Q0.71
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A2EXM0.71
IMDIMIDAZOLEA,B,C3H870.73
IMDIMIDAZOLEA1SQM0.73
IMDIMIDAZOLEA,B3CC10.73
IMDIMIDAZOLEA1AES0.73
IMDIMIDAZOLEA,B2HBA0.73
IMDIMIDAZOLEA,B3FVB0.73
IMDIMIDAZOLEA,B,C,D2QLE0.73
IMDIMIDAZOLEA2OD50.73
IMDIMIDAZOLEA,B2R4J0.73
IMDIMIDAZOLEA,B,C3FY40.73
IMDIMIDAZOLEA,B,C,D1I120.73
IMDIMIDAZOLEA1RUW0.73
IMDIMIDAZOLEA,B3GFF0.73
IMDIMIDAZOLEA,B,C,D1OUW0.73
IMDIMIDAZOLEA1PEE0.73
IMDIMIDAZOLEA,B2DDF0.73
IMDIMIDAZOLEX2AT30.73
IMDIMIDAZOLEA,B1R8E0.73
IMDIMIDAZOLEB,C,E,F1NU90.73
IMDIMIDAZOLEA,B3ECG0.73
IMDIMIDAZOLEA,B2R4E0.73
IMDIMIDAZOLEA1QPI0.73
IMDIMIDAZOLEA,B1HX30.73
IMDIMIDAZOLEA,B,C,D2Z3T0.73
IMDIMIDAZOLEA1L5N0.73
IMDIMIDAZOLEA,B2E2E0.73
IMDIMIDAZOLEA,C,H3F0Y0.73
IMDIMIDAZOLEA,B3D850.73
IMDIMIDAZOLEA1OD80.73
IMDIMIDAZOLET1Y590.73
IMDIMIDAZOLEX3B7U0.73
IMDIMIDAZOLEA1T8K0.73
IMDIMIDAZOLEA3C1J0.73
IMDIMIDAZOLEA2H7Q0.73
IMDIMIDAZOLEA,B1K6Z0.73
IMDIMIDAZOLEA,B,C,D,E,F,G1PZN0.73
IMDIMIDAZOLEA3EER0.73
IMDIMIDAZOLEA1DSO0.73
IMDIMIDAZOLEL1MRD0.73
IMDIMIDAZOLEA,B3EC00.73
IMDIMIDAZOLEA,B2W8X0.73
IMDIMIDAZOLEA1MUN0.73
IMDIMIDAZOLEA,B3C8L0.73
IMDIMIDAZOLEA1YXS0.73
IMDIMIDAZOLEA2NPJ0.73
IMDIMIDAZOLEL1MRC0.73
IMDIMIDAZOLEA2R5R0.73
IMDIMIDAZOLEA1IRC0.73
IMDIMIDAZOLEA2OBL0.73
IMDIMIDAZOLEA,B,C,D3C4E0.73
IMDIMIDAZOLEA3CHR0.73
IMDIMIDAZOLEA,B2ZQN0.73
IMDIMIDAZOLEX1PM10.73
IMDIMIDAZOLEA1V0M0.73
IMDIMIDAZOLEA2NPK0.73
IMDIMIDAZOLEO2G8C0.73
IMDIMIDAZOLEA2WCR0.73
IMDIMIDAZOLEA1CXA0.73
IMDIMIDAZOLEA,B,D1I1D0.73
IMDIMIDAZOLEA3D700.73
IMDIMIDAZOLEA3B7T0.73
IMDIMIDAZOLEA1MBI0.73
IMDIMIDAZOLEA,B,C,D3FCS0.73
IMDIMIDAZOLEA,B,C,D2ZC00.73
IMDIMIDAZOLEA1RKY0.73
IMDIMIDAZOLEA1V2G0.73
IMDIMIDAZOLEA,B,C,D3E490.73
IMDIMIDAZOLEA,B,C,D3HX80.73
IMDIMIDAZOLEA3CGX0.73
IMDIMIDAZOLEL3B7R0.73
IMDIMIDAZOLEA,B,C3DKQ0.73
IMDIMIDAZOLEA2DKK0.73
IMDIMIDAZOLEA,B,C,D1YXU0.73
IMDIMIDAZOLEH,J,L,N1OAU0.73
IMDIMIDAZOLEA2HVF0.73
IMDIMIDAZOLEA,B2V080.73
IMDIMIDAZOLEB,C,D1N1I0.73
IMDIMIDAZOLEA2PSD0.73
IMDIMIDAZOLEA1SXU0.73
IMDIMIDAZOLEA,B,C,D2GPE0.73
IMDIMIDAZOLEA1W7C0.73
IMDIMIDAZOLEA1NOC0.73
IMDIMIDAZOLEA,B3BR00.73
IMDIMIDAZOLEA3C1H0.73
IMDIMIDAZOLEA,B2OWQ0.73
IMDIMIDAZOLEA1HS60.73
IMDIMIDAZOLEA,B2HRC0.73
IMDIMIDAZOLEA3CHQ0.73
IMDIMIDAZOLEA1YXX0.73
IMDIMIDAZOLEA,B,C,D2RD90.73
IMDIMIDAZOLEA2UGI0.73
IMDIMIDAZOLEL1MRE0.73
IMDIMIDAZOLEC,D,G,H1NU70.73
IMDIMIDAZOLEA,B3C2Q0.73
IMDIMIDAZOLEA,B,C,D2G5F0.73
IMDIMIDAZOLEA1UUX0.73
IMDIMIDAZOLEA,B2VD30.73
IMDIMIDAZOLEA1UUY0.73
IMDIMIDAZOLEA4MBA0.73
IMDIMIDAZOLEA3HMZ0.73
IMDIMIDAZOLEA,C1HEZ0.73
IMDIMIDAZOLEA2NQC0.73
IMDIMIDAZOLEA3AKY0.73
IMDIMIDAZOLEA2OPC0.73
IMDIMIDAZOLEA3CHS0.73
IMDIMIDAZOLEA1WEG0.73
IMDIMIDAZOLEA3E2T0.73
IMDIMIDAZOLEA,C3G5O0.73
IMDIMIDAZOLEA2VZ50.73
IMDIMIDAZOLEA1H190.73
IMDIMIDAZOLEA1W8K0.73
IMDIMIDAZOLEA1DP90.73
IMDIMIDAZOLEA3CHP0.73
IMDIMIDAZOLEA,B2E180.73
IMDIMIDAZOLEA2O3P0.73
IMDIMIDAZOLEA2OH30.73
IMDIMIDAZOLEA3DEE0.73
IMDIMIDAZOLEA1DSP0.73
IMDIMIDAZOLET1Y5B0.73
IMDIMIDAZOLEL1MRF0.73
IMDIMIDAZOLEA2NOS0.73
IMDIMIDAZOLEA2NUH0.73
IMDIMIDAZOLEA2NOP0.73
IMDIMIDAZOLEA2PSE0.73
IMDIMIDAZOLEA1NMI0.73
IMDIMIDAZOLEA1DSG0.73
IMDIMIDAZOLEA,B,C,D1VDD0.73
IMDIMIDAZOLEA,B,C,D3EJ80.73
IMDIMIDAZOLEA,B2I6O0.73
IMDIMIDAZOLEA,B2VNQ0.73
IMDIMIDAZOLEA,B2GO30.73
IMDIMIDAZOLEA3GGD0.73
IMDIMIDAZOLEA1IKJ0.73
IMDIMIDAZOLEA2A0I0.73
IMDIMIDAZOLEA,B,C,D2QD10.73
IMDIMIDAZOLEA,B2R460.73
IMDIMIDAZOLEA1AKY0.73
IMDIMIDAZOLEA2VYO0.73
IMDIMIDAZOLEA,B1U170.73
IMDIMIDAZOLEA2C4W0.73
IMDIMIDAZOLEX2F5T0.73
IMDIMIDAZOLEA1GW60.73
IMDIMIDAZOLEA,B2R450.73
IMDIMIDAZOLEA1JRL0.73
IMDIMIDAZOLEA3D710.73
IMDIMIDAZOLEA,B2QD20.73
IMDIMIDAZOLEA2NPC0.73
IMDIMIDAZOLEA,B2QCU0.73
IMDIMIDAZOLEA,B2QZC0.73
IMDIMIDAZOLEA1NOS0.73
IMDIMIDAZOLEA,B,C,D1WWJ0.73
IMDIMIDAZOLEA2VJ80.73
IMDIMIDAZOLEA1W810.73
IMDIMIDAZOLEA,B2AH80.73
IMDIMIDAZOLET1Y5U0.73
IMDIMIDAZOLEA,B,C,D,E,F,
G,H,I,J,K,L
3E6Q0.73
IMDIMIDAZOLEA,B1KAE0.73
IMDIMIDAZOLEA1YWV0.73
IMDIMIDAZOLEA,B3EBZ0.73
IMDIMIDAZOLEA2NPD0.73
IMDIMIDAZOLEA1V0N0.73
IMDIMIDAZOLEA,B3VHB0.73
IMDIMIDAZOLEA1YXV0.73
IMDIMIDAZOLEX2ASN0.73
IMDIMIDAZOLEA,B2D6C0.73
IMDIMIDAZOLEA,B1WKQ0.73
IMDIMIDAZOLEA,B,C,D1GZ50.73
IMDIMIDAZOLEA,B,C1Y5E0.73
IMDIMIDAZOLEA2O630.73
IMDIMIDAZOLEA1DSE0.73
IMDIMIDAZOLEA,B3BQZ0.73
IMDIMIDAZOLEA,B,C,D,E,F2OGJ0.73
IMDIMIDAZOLEA1CCG0.73
IMDIMIDAZOLEA1DS40.73
IMDIMIDAZOLEA1U7R0.73
IMDIMIDAZOLEA1FI90.73
IMDIMIDAZOLEA,B3HDJ0.73
IMDIMIDAZOLEA,B1F4U0.73
IMDIMIDAZOLEA,B1L9E0.73
IMDIMIDAZOLEA1MUY0.73
IMDIMIDAZOLEA1FI70.73
IMDIMIDAZOLEA,B,C,D,E,F,
G,H
1UGI0.73
IMDIMIDAZOLEA,B,C,D2FMY0.73
IMDIMIDAZOLEA2O650.73
IMDIMIDAZOLEA,B2ZEG0.73
IMDIMIDAZOLEA2O640.73
IMDIMIDAZOLEA,B2ZQO0.73
IMDIMIDAZOLET1Y5A0.73
IMDIMIDAZOLEA2ZBX0.73
NVI1-VINYLIMIDAZOLEA,B2AFZ0.77
NVI1-VINYLIMIDAZOLEA1AEJ0.77
6AP9H-PURINE-2,6-DIAMINEA2B570.7
1MZ1-METHYLIMIDAZOLEA1AET0.78
1MZ1-METHYLIMIDAZOLEA1LSX0.78
1MZ1-METHYLIMIDAZOLEA1DUO0.78
1MZ1-METHYLIMIDAZOLEA2H7R0.78
DX42-amino-1,9-dihydro-6H-purine-6-
thione
A,B,C,D3BMG0.73
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.82
2EZ2-ETHYLIMIDAZOLEA1AEQ0.77
4MZ4-METHYLIMIDAZOLEA1DTM0.92
4MZ4-METHYLIMIDAZOLEA,B1KEQ0.92
4MZ4-METHYLIMIDAZOLEA2FNN0.92
4MZ4-METHYLIMIDAZOLEA1MOO0.92
4MZ4-METHYLIMIDAZOLEA1G0E0.92
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.71
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.71
HSOHISTIDINOLA,B1H3J0.72
HSOHISTIDINOLA,B,C,D1KMN0.72
HSOHISTIDINOLA,B2FPU0.72
HSOHISTIDINOLA,B1KAE0.72
HSOHISTIDINOLN2BKD0.72