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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03765499

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EEM[(3S)-3-amino-4-hydroxy-4-oxo-butyl]-
[[(2S,3S,4R,5R)-5-(6-aminopurin-
9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl]-
methyl-selanium		A3E5F0.7
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
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.75
5AD5'-DEOXYADENOSINEB1XRS0.75
5AD5'-DEOXYADENOSINEA,B,C2CC20.75
5AD5'-DEOXYADENOSINEA,B2FB30.75
5AD5'-DEOXYADENOSINEA3CI30.75
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.75
CDY2-CHLORODIDEOXYADENOSINEA1QYE0.7
PG7((2R,3R,5R)-5-(2-AMINO-6-HYDROXY-
9H-PURIN-9-YL)-3-HYDROXY-TETRAHYDROFURAN-
2-YL)METHYL DIHYDROGEN PHOSPHATE		A,B1R4D0.74
PG7((2R,3R,5R)-5-(2-AMINO-6-HYDROXY-
9H-PURIN-9-YL)-3-HYDROXY-TETRAHYDROFURAN-
2-YL)METHYL DIHYDROGEN PHOSPHATE		A2JAO0.74
PG7((2R,3R,5R)-5-(2-AMINO-6-HYDROXY-
9H-PURIN-9-YL)-3-HYDROXY-TETRAHYDROFURAN-
2-YL)METHYL DIHYDROGEN PHOSPHATE		B1S9O0.74
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
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
MAOA1I720.73
UN45-{[(2-AMINO-9H-PURIN-6-YL)OXY]METHYL}-
2-PYRROLIDINONE		A1H0V0.75
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.73
3BH(2R,3R,4S,5R)-2-(6,8-diaminopurin-
9-yl)-5-(hydroxymethyl)oxolane-
3,4-diol		A3FZH0.72
ADNADENOSINEA2JC90.72
ADNADENOSINEA1PG20.72
ADNADENOSINEA,B,C2ZBV0.72
ADNADENOSINEA2DOJ0.72
ADNADENOSINEA,B,C,D1RMT0.72
ADNADENOSINEA,B2C490.72
ADNADENOSINEA,B,C,D3G1U0.72
ADNADENOSINEA,B1Q970.72
ADNADENOSINEA1N3Z0.72
ADNADENOSINEE1FMO0.72
ADNADENOSINEA,B1HO50.72
ADNADENOSINEA,B,C,D2ZBU0.72
ADNADENOSINEA1MRG0.72
ADNADENOSINEA,B,C2EJF0.72
ADNADENOSINEA1MUO0.72
ADNADENOSINEA,B,C,D,E,F1VHW0.72
ADNADENOSINEA,B,C,D,E,F1JDV0.72
ADNADENOSINEA,B1UAY0.72
ADNADENOSINEA1LIK0.72
ADNADENOSINEA,B,C,D3CE60.72
ADNADENOSINEA,B2EJG0.72
ADNADENOSINEA2PKM0.72
ADNADENOSINEA1YI40.72
ADNADENOSINEA1LII0.72
ADNADENOSINEA2EVA0.72
ADNADENOSINEA2Q6K0.72
ADNADENOSINEA1BX40.72
ADNADENOSINEA,B2AC70.72
ADNADENOSINEA,B2B8J0.72
ADNADENOSINEA2FQY0.72
ADNADENOSINEA1Z370.72
ADNADENOSINEA1MRJ0.72
ADNADENOSINEA,B,C1PK70.72
ADNADENOSINEA2PGF0.72
ADNADENOSINEA,B2ZGW0.72
ADNADENOSINEA,B,C,D1JG30.72
ADNADENOSINEA,B,C1WU80.72
ADNADENOSINEA,B,C,D1XWF0.72
ADNADENOSINEA,B,C,D1V8B0.72
ADNADENOSINEA3REQ0.72
ADNADENOSINEA,B2A8T0.72
ADNADENOSINEA1JG20.72
ADNADENOSINEA,B2Q830.72
ADNADENOSINEA,B2B820.72
ADNADENOSINEA,B,C,D,E,F2GL00.72
ADNADENOSINEA,B2W030.72
ADNADENOSINEA,B,C,D1D4F0.72
ADNADENOSINEA,B2OA10.72
ADNADENOSINEA1DGM0.72
ADNADENOSINEA,B,C,D,E,F1ODI0.72
ADNADENOSINEA3FUU0.72
CMG6-O-CYCLOHEXYLMETHYL GUANINEA,C1H1P0.75
CMG6-O-CYCLOHEXYLMETHYL GUANINEA1E1V0.75
9MG9-METHYLGUANINEA1RRW0.81
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL		A,B1I5V0.75
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B,C,D2FLH0.72
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B,C,D3C0V0.72
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A2QIM0.72
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B3D7W0.72
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A1W1R0.72
BOA2-BROMO-6-HYDROXY-PURINEA1M670.73
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.76
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.76
M8M5'-{[2-(aminooxy)ethyl](methyl)amino}-
5'-deoxy-8-methyladenosine		A,B3DZ50.73
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.77
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A2ZI40.72
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C,D2ZI50.72
5F15'-FLUORO-2',5'-DIDEOXYADENOSINEA,B,C2C5B0.72
MHZ5'-DEOXY-5'-[(3-HYDRAZINOPROPYL)METHYLAMINO]ADENOSINEA1I790.7
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B,C1PW70.72
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B3GLQ0.72
EH9(2S,3R)-3-(6-amino-9H-purin-9-yl)nonan-
2-ol		A2Z7G0.75
ADC(1'R,2'S)-9-(2-HYDROXY-3'-KETO-
CYCLOPENTEN-1-YL)ADENINE		A,B1A7A0.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B2Z3K0.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PR60.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1ZTF0.72
6GO6-O-methylguanineA3FO60.84
6GO6-O-methylguanineA3GES0.84
26A6N-DIMETHYLADENOSINEA2A9Y0.73
26A6N-DIMETHYLADENOSINEA2A9Z0.73
RGT2-amino-9-{5-O-[(R)-hydroxy{[(R)-
hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-
beta-D-ribofuranosyl}-9H-purin-
6-yl 5-O-phosphono-beta-D-ribofuranoside		A,B3DZI0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D,E,F,
G,H		1QPY0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1RRU0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1PDT0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1PUP0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1NR80.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1XJ90.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A176D0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D1HZS0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B2K4G0.71
ZAD(S)-1'-(2',3'-DIHYDROXYPROPYL)-
ADENINE		A2JJA0.76
A8M5'-[(3-aminopropyl)(methyl)amino]-
5'-deoxy-8-methyladenosine		A,B3DZ20.73
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.8
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1OBC0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A2V0C0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1H3N0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1OBH0.7
N696-(CYCLOHEXYLMETHOXY)-8-ISOPROPYL-
9H-PURIN-2-AMINE		A1W8C0.72
NDM7,9-DIMETHYLGUANINEA1JSZ0.74
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1D850.8
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B130D0.8
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B144D0.8
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B128D0.8
GMC(2R,3R,4S,5S)-4-AMINO-2-[6-(DIMETHYLAMINO)-
9H-PURIN-9-YL]-5-(HYDROXYMETHYL)TETRAHYDRO-
3-FURANOL		A1GPJ0.73
M2T5'-deoxy-5'-(dimethyl-lambda~4~-
sulfanyl)adenosine		A,B3H0V0.71
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATE0,Y,Z2OW80.7
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATEA1WTT0.7
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATE2,Y2QNH0.7
MA66N-DIMETHYLADENOSINE-5'-MONOPHOSHATEA1WTS0.7
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.8
ZEZ(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B3D7W0.72
N8M5'-deoxy-5'-(dimethylamino)-8-methyladenosineA,B3H0W0.74
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM		A,B1PU70.71
M8E5'-{[4-(aminooxy)butyl](methyl)amino}-
5'-deoxy-8-ethenyladenosine		A,B3DZ60.71
DEAD-ERITADENINEA,B,C,D,E,F,
G,H		1K0U0.71
3DH5'-S-ethyl-5'-thioadenosineA,B,C,D3DHY0.7
6OGA,B,C,D,E,F2HHW0.81
6OGA,B,C,D,E,F2HVH0.81
6OGA,B1D240.81
6OGA,T2J6S0.81
6OGA,C2HW30.81
6OGA,T2J6T0.81
6OGA,P,T2J6U0.81
6OGA,C2HHT0.81
6OGA,B218D0.81
6OGA,C2HHX0.81
6OGA,B2HHQ0.81
6OGA,C2HHV0.81
6OGA,B,E2O8C0.81
6OGA,B153D0.81
6OGB1T380.81
6OGA,B2HHS0.81
6OGA,C2HHU0.81
6OGA,B1D270.81
CL92-chloro-2'-deoxyadenosineA,B2ZIA0.71
CL92-chloro-2'-deoxyadenosineA,B2ZI90.71
ITTA2E5X0.73
ITTA,B2Q160.73
ITTA2DVO0.73
ITTA,B,C,D,E,F,
G,H		2J4E0.73
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C3GGS0.71
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A1Z340.71
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C1PKE0.71
FA25-(6-AMINO-9H-PURIN-9-YL)-4-HYDROXYTETRAHYDROFURAN-
3-YL DIHYDROGEN PHOSPHATE		A,B1PWF0.72
5CD5'-CHLORO-5'-DEOXYADENOSINEA2Q6I0.71
5CD5'-CHLORO-5'-DEOXYADENOSINEA2Q6L0.71
5CD5'-CHLORO-5'-DEOXYADENOSINEA,B,C2C2W0.71
3AD3'-DEOXYADENOSINEA,B3B4B0.72
3AD3'-DEOXYADENOSINEA,B3B4C0.72
3AD3'-DEOXYADENOSINEA,B1FA00.72
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B1Z5O0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C3B7P0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D3C6M0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA3FUW0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C3FUX0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C2HTE0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C1JDT0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA1CG60.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O060.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA2IPX0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D2E5W0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2YY80.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D,E,F,
G,H,I,J,K,L		2A8Y0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA1EG20.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B,C,D3C6K0.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O070.71
MTA5'-DEOXY-5'-METHYLTHIOADENOSINEA,B2O050.71
TNV[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-
TRIPHOSPHATE		A,B,P1T050.75
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B1ZOT0.76
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B,C,D,E,F1PK00.76
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG10.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG40.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG30.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1LON0.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA,B1LNY0.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG00.75
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1P9B0.75
MBP1-[(2-AMINO-6,9-DIHYDRO-1H-PURIN-
6-YL)OXY]-3-METHYL-2-BUTANOL		A1GZ80.78
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C1S2G0.72
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C2C5H0.72
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B2Z3M0.72
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B,C,D2ZI60.72
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol		A,B2ZI30.72
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA2I2B0.76
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA,B,C2CBX0.76
NOSINOSINEA,B,C1PR00.77
NOSINOSINEA,B1KIC0.77
NOSINOSINEA,B,C,D3B9X0.77
NOSINOSINEE1RCT0.77
NOSINOSINEA2FQW0.77
NOSINOSINEA1Z380.77
NOSINOSINEA1A9S0.77
NOSINOSINEA2BSX0.77
DOI9-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)-
9H-PURINE		A2DGN0.75
DOI9-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)-
9H-PURINE		A2GCQ0.75