Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02456777
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
101![]() | A,B,C | 1CS4 | 0.72 | ![]() | |
2FD![]() | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A,B,C | 3GGS | 0.73 | ![]() |
2FD![]() | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A | 1Z34 | 0.73 | ![]() |
2FD![]() | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A,B,C | 1PKE | 0.73 | ![]() |
3AM![]() | [(2R,3S,4R,5R)-5-(6-aminopurin- 9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan- 3-yl] dihydrogen phosphate | A | 3C0I | 0.73 | ![]() |
3AM![]() | [(2R,3S,4R,5R)-5-(6-aminopurin- 9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan- 3-yl] dihydrogen phosphate | A,B | 3C0G | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C,D | 1I9C | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | B | 1XRS | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C | 2CC2 | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B | 2FB3 | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A | 3CI3 | 0.73 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C,D | 4REQ | 0.73 | ![]() |
3L1![]() | (2S,3R,5S)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A | 2ZI4 | 0.74 | ![]() |
3L1![]() | (2S,3R,5S)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C,D | 2ZI5 | 0.74 | ![]() |
2BU![]() | A | 1U6C | 0.71 | ![]() | |
2BU![]() | A | 1U6O | 0.71 | ![]() | |
2FA![]() | 2-(6-AMINO-2-FLUORO-PURIN-9-YL)- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3,4-DIOL | A | 1Z35 | 0.75 | ![]() |
2FA![]() | 2-(6-AMINO-2-FLUORO-PURIN-9-YL)- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3,4-DIOL | A | 2PKK | 0.75 | ![]() |
2FA![]() | 2-(6-AMINO-2-FLUORO-PURIN-9-YL)- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3,4-DIOL | A,B,C,D | 2ZJ0 | 0.75 | ![]() |
2FA![]() | 2-(6-AMINO-2-FLUORO-PURIN-9-YL)- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3,4-DIOL | A,B,C | 1PK9 | 0.75 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A,B | 1FA0 | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A | 1Q79 | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A,B,C,D,E,F, O,P,Q,R,S,T | 1XFV | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A,B | 3C23 | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A,B,C,D,E,F | 1K90 | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A | 1F5A | 0.71 | ![]() |
3AT![]() | 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE | A | 1Q78 | 0.71 | ![]() |
2AD![]() | 2'-AMINO-2'-DEOXYADENOSINE | A,D | 2BTE | 0.72 | ![]() |
2AD![]() | 2'-AMINO-2'-DEOXYADENOSINE | A,B | 2H0X | 0.72 | ![]() |
2AD![]() | 2'-AMINO-2'-DEOXYADENOSINE | A,B | 2GCS | 0.72 | ![]() |
2AD![]() | 2'-AMINO-2'-DEOXYADENOSINE | A | 1OBC | 0.72 | ![]() |
2AM![]() | ADENOSINE-2'-MONOPHOSPHATE | A | 7RNT | 0.73 | ![]() |
2AM![]() | ADENOSINE-2'-MONOPHOSPHATE | A | 1PGQ | 0.73 | ![]() |
2AM![]() | ADENOSINE-2'-MONOPHOSPHATE | A | 6RNT | 0.73 | ![]() |
2AM![]() | ADENOSINE-2'-MONOPHOSPHATE | A | 1RGK | 0.73 | ![]() |
5AA![]() | N6-DIMETHYL-3'-AMINO-ADENOSINE- 5'-MONOPHOSPHATE | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.71 | ![]() |
5AA![]() | N6-DIMETHYL-3'-AMINO-ADENOSINE- 5'-MONOPHOSPHATE | 0,1,3,4,9,A, B,C,H,J,K,L, M,N,O,Q,R,S, T,U,Y,Z | 1VQ7 | 0.71 | ![]() |
5AA![]() | N6-DIMETHYL-3'-AMINO-ADENOSINE- 5'-MONOPHOSPHATE | 0,1,2,3,4,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ5 | 0.71 | ![]() |
5AA![]() | N6-DIMETHYL-3'-AMINO-ADENOSINE- 5'-MONOPHOSPHATE | 0,1,3,4,9,A, B,C,H,J,K,L, M,N,O,Q,R,S, T,U,Y,Z | 1VQ4 | 0.71 | ![]() |
2PR![]() | 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]- 9H-PURINE-5'-MONOPHOSPHATE | B | 1U1P | 0.74 | ![]() |
2PR![]() | 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]- 9H-PURINE-5'-MONOPHOSPHATE | A,B,C,D,E,F | 2IBS | 0.74 | ![]() |
2PR![]() | 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]- 9H-PURINE-5'-MONOPHOSPHATE | B | 1U1R | 0.74 | ![]() |
2PR![]() | 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]- 9H-PURINE-5'-MONOPHOSPHATE | R,S | 1U1Y | 0.74 | ![]() |
2PR![]() | 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]- 9H-PURINE-5'-MONOPHOSPHATE | A,B,C,D,E,F | 2IBT | 0.74 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | A | 1S1K | 0.72 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | A,B | 1D76 | 0.72 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | A,M | 1ZAY | 0.72 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | A | 211D | 0.72 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | C,E | 3C29 | 0.72 | ![]() |
1AP![]() | 2,6-DIAMINOPURINE NUCLEOTIDE | A | 210D | 0.72 | ![]() |
3BH![]() | (2R,3R,4S,5R)-2-(6,8-diaminopurin- 9-yl)-5-(hydroxymethyl)oxolane- 3,4-diol | A | 3FZH | 0.76 | ![]() |
3AD![]() | 3'-DEOXYADENOSINE | A,B | 3B4B | 0.75 | ![]() |
3AD![]() | 3'-DEOXYADENOSINE | A,B | 3B4C | 0.75 | ![]() |
3AD![]() | 3'-DEOXYADENOSINE | A,B | 1FA0 | 0.75 | ![]() |
3D1![]() | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C | 1S2G | 0.74 | ![]() |
3D1![]() | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C | 2C5H | 0.74 | ![]() |
3D1![]() | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B | 2Z3M | 0.74 | ![]() |
3D1![]() | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C,D | 2ZI6 | 0.74 | ![]() |
3D1![]() | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B | 2ZI3 | 0.74 | ![]() |
26A![]() | 6N-DIMETHYLADENOSINE | A | 2A9Y | 0.76 | ![]() |
26A![]() | 6N-DIMETHYLADENOSINE | A | 2A9Z | 0.76 | ![]() |
3DA![]() | 3'-DEOXYADENOSINE-5'-MONOPHOSPHATE | A,B,D | 2P7F | 0.73 | ![]() |
3DA![]() | 3'-DEOXYADENOSINE-5'-MONOPHOSPHATE | D,R | 1S77 | 0.73 | ![]() |
3AN![]() | A,B,C | 1HIY | 0.7 | ![]() |