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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03801195

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AHZADENOSINE DIPHOSPHATE 5-(BETA-ETHYL)-
4-METHYL-THIAZOLE-2-CARBOXYLIC ACID
A,B2GJC0.7
AHZADENOSINE DIPHOSPHATE 5-(BETA-ETHYL)-
4-METHYL-THIAZOLE-2-CARBOXYLIC ACID
A,B1RP00.7
3DH5'-S-ethyl-5'-thioadenosineA,B,C,D3DHY0.71
223(3R,4R)-1-[(4-AMINO-5H-PYRROLO[3,2-
D]PYRIMIDIN-7-YL)METHYL]-4-(HYDROXYMETHYL)PYRROLIDIN-
3-OL
A,B,C,D,E,F2ISC0.71
3AA3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATEA,B,E,F1F6M0.78
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZG0.72
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA1DRV0.72
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B2EWD0.72
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZF0.72
1DA1-DEAZA-ADENOSINEA1ADD0.82
8IDNICOTINAMIDE-8-IODO-ADENINE-DINUCLEOTIDEA,B,C,D2HCY0.71
ABR(R)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5E0.74
AATS-ADENOSYL-1,8-DIAMINO-3-THIOOCTANEA,C,D1JQ30.75
AATS-ADENOSYL-1,8-DIAMINO-3-THIOOCTANEA,B,C2I7C0.75
AD33-DEAZA-ADENOSINEA,B1KIE0.82
AD33-DEAZA-ADENOSINEA,B,C,D2ZIZ0.82
AD33-DEAZA-ADENOSINEA,B1R4F0.82
AD33-DEAZA-ADENOSINEA,B1HP00.82
BIG(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-
d]pyrimidin-7-yl)methyl]-4-[(butylsulfanyl)methyl]pyrrolidin-
3-ol
A,C3DP90.73
3DD(2R,3R)-4-(4-AMINO-1H-IMIDAZO[4,5-
C]PYRIDIN-1-YL)-2,3-DIHYDROXYBUTANOIC ACID
A,B,C,D,E,F,
G,H
2H5L0.72
1RB1-ALPHA-D-RIBOFURANOSYL-BENZIMIAZOLE-
5'-PHOSPHATE
A1L5K0.78
DAK4-(N,N-DIMETHYLAMINO)CINNAMOYL-
COA
A,B,C,D,E,F1EY30.74
AAD(2-AMINOOXY-ETHYL)-[5-(6-AMINO-
PURIN-9-YL)-3,4-DIHYDROXY-TETRAHYDRO-
FURAN-2-YLMETHYL]-METHYL-SULFONIUM
A1M4N0.71
3BK(2R,3R,4S,5R)-2-[6-amino-8-[(3,4-
dichlorophenyl)methylamino]purin-
9-yl]-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZK0.76
ANZA2V0C0.72
ANZA,B,D,F2V0G0.72
CA3COA-S-TRIMETHYLENE-ACETYL-TRYPTAMINEA1KUX0.72
ABS(S)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5F0.74
COTCOA-S-ACETYL TRYPTAMINEA1KUY0.71
COTCOA-S-ACETYL TRYPTAMINEE,F,G,H1IB10.71
COTCOA-S-ACETYL TRYPTAMINEA1CJW0.71
COTCOA-S-ACETYL TRYPTAMINEA1L0C0.71