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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02309439

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DEAD-ERITADENINEA,B,C,D,E,F,
G,H
1K0U0.72
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1D850.75
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B130D0.75
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B144D0.75
G36O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B128D0.75
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.74
A662-AMINOETHYLLYSINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.71
UN45-{[(2-AMINO-9H-PURIN-6-YL)OXY]METHYL}-
2-PYRROLIDINONE
A1H0V0.74
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE
A,B1ZOT0.73
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE
A,B,C,D,E,F1PK00.73
CMG6-O-CYCLOHEXYLMETHYL GUANINEA,C1H1P0.73
CMG6-O-CYCLOHEXYLMETHYL GUANINEA1E1V0.73
DOI9-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)-
9H-PURINE
A2DGN0.71
DOI9-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)-
9H-PURINE
A2GCQ0.71
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.7
5AD5'-DEOXYADENOSINEB1XRS0.7
5AD5'-DEOXYADENOSINEA,B,C2CC20.7
5AD5'-DEOXYADENOSINEA,B2FB30.7
5AD5'-DEOXYADENOSINEA3CI30.7
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.7
SAIS-ADENOSYL-L-HOMOSELENOCYSTEINEA,B2AVN0.7
SAIS-ADENOSYL-L-HOMOSELENOCYSTEINEA1XTP0.7
SAIS-ADENOSYL-L-HOMOSELENOCYSTEINEA,B1IM80.7
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
A3E5F0.71
BOA2-BROMO-6-HYDROXY-PURINEA1M670.71
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.73
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.73
TNV[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-
TRIPHOSPHATE
A,B,P1T050.72
9MG9-METHYLGUANINEA1RRW0.78
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG10.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG40.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG30.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1LON0.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA,B1LNY0.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1CG00.7
IMO6-O-PHOSPHORYL INOSINE MONOPHOSPHATEA1P9B0.7
6OGA,B,C,D,E,F2HHW0.76
6OGA,B,C,D,E,F2HVH0.76
6OGA,B1D240.76
6OGA,T2J6S0.76
6OGA,C2HW30.76
6OGA,T2J6T0.76
6OGA,P,T2J6U0.76
6OGA,C2HHT0.76
6OGA,B218D0.76
6OGA,C2HHX0.76
6OGA,B2HHQ0.76
6OGA,C2HHV0.76
6OGA,B,E2O8C0.76
6OGA,B153D0.76
6OGB1T380.76
6OGA,B2HHS0.76
6OGA,C2HHU0.76
6OGA,B1D270.76
SA8S-5'-AZAMETHIONINE-5'-DEOXYADENOSINEA,B,C2C4T0.7
SA8S-5'-AZAMETHIONINE-5'-DEOXYADENOSINEA1Z3C0.7
SA8S-5'-AZAMETHIONINE-5'-DEOXYADENOSINEA,B,C2H2E0.7
ZAD(S)-1'-(2',3'-DIHYDROXYPROPYL)-
ADENINE
A2JJA0.72
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.76
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.76
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA2I2B0.71
CC5BETA-D-ERYTHROFURANOSYL-ADENOSINEA,B,C2CBX0.71
MBP1-[(2-AMINO-6,9-DIHYDRO-1H-PURIN-
6-YL)OXY]-3-METHYL-2-BUTANOL
A1GZ80.78
6GO6-O-methylguanineA3FO60.82
6GO6-O-methylguanineA3GES0.82
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL
A,B1I5V0.71
NOSINOSINEA,B,C1PR00.72
NOSINOSINEA,B1KIC0.72
NOSINOSINEA,B,C,D3B9X0.72
NOSINOSINEE1RCT0.72
NOSINOSINEA2FQW0.72
NOSINOSINEA1Z380.72
NOSINOSINEA1A9S0.72
NOSINOSINEA2BSX0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.78
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.78
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.74