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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02317717

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2BP9H-purin-2-amineA3G4M0.87
PURPURINE RIBOSIDEA1FKW0.7
PURPURINE RIBOSIDEA1UIP0.7
YF45-{[ETHYL(METHYL)AMINO]METHYL}-
2-METHYL-5,6-DIHYDROPYRIMIDIN-4-
AMINE		A,B1T9A0.74
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.72
6MP6-METHYLPURINEA,B,C1OU40.76
6MP6-METHYLPURINEA,B,C1OTY0.76
6MP6-METHYLPURINEA2PUA0.76
M011-[1-(9H-purin-6-yl)piperidin-4-
yl]methanamine		A2VNW0.76
ADEADENINEA1WEI0.77
ADEADENINEA2QLU0.77
ADEADENINEA,B2H8G0.77
ADEADENINEA,B1HQC0.77
ADEADENINEA1AHA0.77
ADEADENINEA,B,C,D,E,F,
G,H		1BJQ0.77
ADEADENINEA,B,D1YXM0.77
ADEADENINEA1CB00.77
ADEADENINEA,B2QTT0.77
ADEADENINEA,B,C1XE80.77
ADEADENINEA,B1M2T0.77
ADEADENINEA2P8N0.77
ADEADENINEA,B,C2PQJ0.77
ADEADENINEA,B,C1VRL0.77
ADEADENINEA,B3BSF0.77
ADEADENINEX1Y260.77
ADEADENINEA,B1ZN70.77
ADEADENINEA,B1Z5N0.77
ADEADENINEA1QB70.77
ADEADENINEA1LU10.77
ADEADENINEA,B1Q8Y0.77
ADEADENINEA2QES0.77
ADEADENINEA2PUB0.77
ADEADENINEA1Z8D0.77
ADEADENINEA1JH80.77
ADEADENINEA1QD20.77
ADEADENINEA2ICS0.77
ADEADENINEA1IFS0.77
ADEADENINEA1NLI0.77
ADEADENINEA,B1D2A0.77
ADEADENINEA1GIU0.77
ADEADENINEA1J1R0.77
ADEADENINEA2QET0.77
ADEADENINEA,B,C1OD40.77
ADEADENINEA,B1QCI0.77
ADEADENINEA,B,C,D,E,F2GA40.77
ADEADENINEA,B1JYS0.77
ADEADENINEA1LPD0.77
ADEADENINEA,B1OD20.77
ADEADENINEA1WTA0.77
ADEADENINEA,B,C1S2D0.77
ADEADENINEA1MUD0.77
ADEADENINEA2PUE0.77
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B1ZOT0.74
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B,C,D,E,F1PK00.74
IHE6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-
1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE		A1U9V0.77
P2PN7-(5'-PHOSPHO-ALPHA-RIBOSYL)-2-
HYDROXYPURINE		A1JHR0.71
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.75
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE		A,B1T9B0.72
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE		I1E800.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		B1U1P0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		A,B,C,D,E,F2IBS0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		B1U1R0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		R,S1U1Y0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		A,B,C,D,E,F2IBT0.72
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.84
PM69H-purine-6-thiolA,B3BGD0.7
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
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL		A,B1I5V0.77
CFP6-CHLORO-2-FLUOROPURINEA1JDJ0.7
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,C1T0D0.71
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		B,D2BCY0.71
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,B,C3BBI0.71
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,B,C3B910.71
103A,B,C1CUL0.7
PR5B2DD20.72
PR5B2DD10.72
PR5B2DD30.72
PR5A,B,C,D,E,F,
G,H		2B3J0.72
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM		A,B1PU70.85
7RA7-ALPHA-D-RIBOFURANOSYL-2-AMINOPURINE-
5'-PHOSPHATE		A1L5M0.71
EH9(2S,3R)-3-(6-amino-9H-purin-9-yl)nonan-
2-ol		A2Z7G0.73
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.75
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.75
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE		A1W1Q0.79
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE		A2EXM0.79
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.8
3MA6-AMINO-3-METHYLPURINEA3MAG0.81
6AP9H-PURINE-2,6-DIAMINEA2B570.77
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine		A,B2W6Z0.8
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.8
6GU6-chloroguanineA3FO40.73
6GU6-chloroguanineA3GOG0.73
6GU6-chloroguanineA3GER0.73
ZEZ(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B3D7W0.72
A2F2-fluoroadenineA3GOT0.76
A2F2-fluoroadenineA,B,C3GB90.76
301N6-(penta-2,3-dienyl)adenineA3BW70.79
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D,E,F,
G,H		1QPY0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1RRU0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1PDT0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1PUP0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		B1NR80.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B1XJ90.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A176D0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B,C,D1HZS0.73
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE		A,B2K4G0.73
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.8
BP16-BROMO-7H-PURINEA,B,C1S2I0.72
PRNB1CL80.73
PRNB1U1L0.73
PRNB1U1N0.73
M1A6-AMINO-1-METHYLPURINEA1B420.81
7RP7-ALPHA-D-RIBOFURANOSYL-PURINE-
5'-PHOSPHATE		A1L5L0.72
ZAD(S)-1'-(2',3'-DIHYDROXYPROPYL)-
ADENINE		A2JJA0.72
LG3PYRIMIDINE-2,4-DIAMINEA2EUN0.71
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.71
5AD5'-DEOXYADENOSINEB1XRS0.71
5AD5'-DEOXYADENOSINEA,B,C2CC20.71
5AD5'-DEOXYADENOSINEA,B2FB30.71
5AD5'-DEOXYADENOSINEA3CI30.71
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.71
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C,D2C7O0.72
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C2C7P0.72
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C,D2C7R0.72
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C2C7Q0.72
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.79
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.79
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.78
P5PA,B1MV60.72
P5PA,B1MV10.72
P5PA,B1MV20.72
P5PB1XV00.72
P5PA1RBN0.72
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.75
TNV[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-
TRIPHOSPHATE		A,B,P1T050.73
JNFN-cyclohexyl-4-imidazo[1,2-a]pyridin-
3-yl-N-methylpyrimidin-2-amine		A3CGF0.71
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA2I2B0.71
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA,B,C2CBX0.71
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.72
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.8