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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02068989

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
C8M3-[{[(2R,3S,4R,5R)-5-(6-amino-8-
methyl-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-
2-yl]methyl}(methyl)amino]propanamide		A,B3DZ40.7
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATE0,Y,Z2OW80.71
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATEA1WTT0.71
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATE2,Y2QNH0.71
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATEA1WTS0.71
O8M2-[{[(2R,3S,4R,5R)-5-(6-amino-8-
methyl-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-
2-yl]methyl}(methyl)amino]acetamide		A,B3DZ70.7
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.73
3MA6-AMINO-3-METHYLPURINEA3MAG0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1M5K0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3BBI0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B3B5A0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C1X9C0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEC,D1JBS0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B1L3M0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C2D2K0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C,D2FIL0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B2FIJ0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B168D0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,D2D2L0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B3CR10.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3BBM0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,D1ZFT0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEE,F,G,H,P,Q,
R,S		2NZ40.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C2OUE0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3B5S0.7
IHE6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-
1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE		A1U9V0.72
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA2I2B0.75
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA,B,C2CBX0.75
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA8ICU0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJV0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P,T1ZYQ0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA1KEJ0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P1SKR0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJT0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C,P,Q1SL00.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEP2IMW0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJU0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,T2BQU0.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P,T1SL20.7
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,B1QSY0.7
M1A6-AMINO-1-METHYLPURINEA1B420.7
3DH5'-S-ethyl-5'-thioadenosineA,B,C,D3DHY0.71
MAOA1I720.74
MHZ5'-DEOXY-5'-[(3-HYDRAZINOPROPYL)METHYLAMINO]ADENOSINEA1I790.73
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.74
5AD5'-DEOXYADENOSINEB1XRS0.74
5AD5'-DEOXYADENOSINEA,B,C2CC20.74
5AD5'-DEOXYADENOSINEA,B2FB30.74
5AD5'-DEOXYADENOSINEA3CI30.74
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.74
26A6N-DIMETHYLADENOSINEA2A9Y0.74
26A6N-DIMETHYLADENOSINEA2A9Z0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.7
TNV[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-
TRIPHOSPHATE		A,B,P1T050.8
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM		A,B1PU70.74
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C1S2G0.71
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C2C5H0.71
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B2Z3M0.71
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C,D2ZI60.71
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B2ZI30.71
M8M5'-{[2-(aminooxy)ethyl](methyl)amino}-
5'-deoxy-8-methyladenosine		A,B3DZ50.73
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.8
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.7
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.7
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.7
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.7
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.81
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.81
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B1Z5O0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C3B7P0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D3C6M0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA3FUW0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C3FUX0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C2HTE0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C1JDT0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA1CG60.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O060.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA2IPX0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D2E5W0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2YY80.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D,E,F,
G,H,I,J,K,L		2A8Y0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA1EG20.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D3C6K0.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O070.7
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O050.7
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B1ZOT0.77
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B,C,D,E,F1PK00.77
6HA1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(ADENIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		B1EJZ0.71
6HA1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(ADENIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A,B,C,D,E,G2BJ60.71
6HA1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(ADENIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A481D0.71
6HA1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(ADENIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A1D7Z0.71
103A,B,C1CUL0.72
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.78
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL		A,B1I5V0.78
A8M5'-[(3-aminopropyl)(methyl)amino]-
5'-deoxy-8-methyladenosine		A,B3DZ20.73
CDY2-CHLORODIDEOXYADENOSINEA1QYE0.71
M2T5'-deoxy-5'-(dimethyl-lambda~4~-
sulfanyl)adenosine		A,B3H0V0.71
RP16-(6-AMINO-PURIN-9-YL)-2-THIOXO-
TETRAHYDRO-2-FURO[3,2-D][1,3,2]DIOXAPHOSPHININE-
2,7-DIOL		A1NE40.7
ADNADENOSINEA2JC90.71
ADNADENOSINEA1PG20.71
ADNADENOSINEA,B,C2ZBV0.71
ADNADENOSINEA2DOJ0.71
ADNADENOSINEA,B,C,D1RMT0.71
ADNADENOSINEA,B2C490.71
ADNADENOSINEA,B,C,D3G1U0.71
ADNADENOSINEA,B1Q970.71
ADNADENOSINEA1N3Z0.71
ADNADENOSINEE1FMO0.71
ADNADENOSINEA,B1HO50.71
ADNADENOSINEA,B,C,D2ZBU0.71
ADNADENOSINEA1MRG0.71
ADNADENOSINEA,B,C2EJF0.71
ADNADENOSINEA1MUO0.71
ADNADENOSINEA,B,C,D,E,F1VHW0.71
ADNADENOSINEA,B,C,D,E,F1JDV0.71
ADNADENOSINEA,B1UAY0.71
ADNADENOSINEA1LIK0.71
ADNADENOSINEA,B,C,D3CE60.71
ADNADENOSINEA,B2EJG0.71
ADNADENOSINEA2PKM0.71
ADNADENOSINEA1YI40.71
ADNADENOSINEA1LII0.71
ADNADENOSINEA2EVA0.71
ADNADENOSINEA2Q6K0.71
ADNADENOSINEA1BX40.71
ADNADENOSINEA,B2AC70.71
ADNADENOSINEA,B2B8J0.71
ADNADENOSINEA2FQY0.71
ADNADENOSINEA1Z370.71
ADNADENOSINEA1MRJ0.71
ADNADENOSINEA,B,C1PK70.71
ADNADENOSINEA2PGF0.71
ADNADENOSINEA,B2ZGW0.71
ADNADENOSINEA,B,C,D1JG30.71
ADNADENOSINEA,B,C1WU80.71
ADNADENOSINEA,B,C,D1XWF0.71
ADNADENOSINEA,B,C,D1V8B0.71
ADNADENOSINEA3REQ0.71
ADNADENOSINEA,B2A8T0.71
ADNADENOSINEA1JG20.71
ADNADENOSINEA,B2Q830.71
ADNADENOSINEA,B2B820.71
ADNADENOSINEA,B,C,D,E,F2GL00.71
ADNADENOSINEA,B2W030.71
ADNADENOSINEA,B,C,D1D4F0.71
ADNADENOSINEA,B2OA10.71
ADNADENOSINEA1DGM0.71
ADNADENOSINEA,B,C,D,E,F1ODI0.71
ADNADENOSINEA3FUU0.71
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.73
3BH(2R,3R,4S,5R)-2-(6,8-diaminopurin-
9-yl)-5-(hydroxymethyl)oxolane-
3,4-diol		A3FZH0.71
N8M5'-deoxy-5'-(dimethylamino)-8-methyladenosineA,B3H0W0.74
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.82
M8E5'-{[4-(aminooxy)butyl](methyl)amino}-
5'-deoxy-8-ethenyladenosine		A,B3DZ60.71
EH9(2S,3R)-3-(6-amino-9H-purin-9-yl)nonan-
2-ol		A2Z7G0.76
M011-[1-(9H-purin-6-yl)piperidin-4-
yl]methanamine		A2VNW0.72
ZAD(S)-1'-(2',3'-DIHYDROXYPROPYL)-
ADENINE		A2JJA0.75
SP16-(6-AMINO-PURIN-9-YL)-2-THIOXO-
TETRAHYDRO-2-FURO[3,2-D][1,3,2]DIOXAPHOSPHININE-
2,7-DIOL		A1NE60.7
SP16-(6-AMINO-PURIN-9-YL)-2-THIOXO-
TETRAHYDRO-2-FURO[3,2-D][1,3,2]DIOXAPHOSPHININE-
2,7-DIOL		E,R3CF60.7
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.82
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D,E,F,
G,H		1QPY0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1RRU0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1PDT0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1PUP0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1NR80.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1XJ90.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A176D0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D1HZS0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B2K4G0.72
FA25-(6-AMINO-9H-PURIN-9-YL)-4-HYDROXYTETRAHYDROFURAN-
3-YL DIHYDROGEN PHOSPHATE		A,B1PWF0.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B2Z3K0.71
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PR60.71
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1ZTF0.71
3AD3'-DEOXYADENOSINEA,B3B4B0.72
3AD3'-DEOXYADENOSINEA,B3B4C0.72
3AD3'-DEOXYADENOSINEA,B1FA00.72
XAD9-(2,3-DIDEOXY-6-O-PHOSPHONO-BETA-
D-ERYTHRO-HEXOPYRANOSYL)-9H-PURIN-
6-AMINE		A,B2H9S0.7
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B,C1PW70.71
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B3GLQ0.71
5F15'-FLUORO-2',5'-DIDEOXYADENOSINEA,B,C2C5B0.71
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A2ZI40.71
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C,D2ZI50.71
GMC(2R,3R,4S,5S)-4-AMINO-2-[6-(DIMETHYLAMINO)-
9H-PURIN-9-YL]-5-(HYDROXYMETHYL)TETRAHYDRO-
3-FURANOL		A1GPJ0.72
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.71