Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03450776
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 |
3AA | 3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATE | A,B,E,F | 1F6M | 0.72 | |
1DA | 1-DEAZA-ADENOSINE | A | 1ADD | 0.79 | |
TAP | 7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | A | 1DR2 | 0.72 | |
TAP | 7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | A | 1DR3 | 0.72 | |
TAP | 7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | A,B | 1PT9 | 0.72 | |
P2P | N7-(5'-PHOSPHO-ALPHA-RIBOSYL)-2- HYDROXYPURINE | A | 1JHR | 0.71 | |
7DA | 7-DEAZA-2'-DEOXYADENOSINE-5'-MONOPHOSPHATE | B | 1U1K | 0.94 | |
M8E | 5'-{[4-(aminooxy)butyl](methyl)amino}- 5'-deoxy-8-ethenyladenosine | A,B | 3DZ6 | 0.7 | |
CDY | 2-CHLORODIDEOXYADENOSINE | A | 1QYE | 0.72 | |
PUR | PURINE RIBOSIDE | A | 1FKW | 0.72 | |
PUR | PURINE RIBOSIDE | A | 1UIP | 0.72 | |
MDR | 9-(2-DEOXY-BETA-D-RIBOFURANOSYL)- 6-METHYLPURINE | A,B,C | 1PR2 | 0.75 | |
MDR | 9-(2-DEOXY-BETA-D-RIBOFURANOSYL)- 6-METHYLPURINE | A,B,C | 1OVG | 0.75 | |
EDA | 3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE | A,B | 150D | 0.7 | |
EDA | 3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE | A,P,T | 2DPJ | 0.7 | |
EDA | 3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE | A,P,T | 2DPI | 0.7 | |
EDA | 3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE | A,D | 1EWN | 0.7 | |
EDA | 3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE | A,D | 1F4R | 0.7 | |
7GU | 7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 2QEF | 0.75 | |
7GU | 7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,C | 1YQM | 0.75 | |
7GU | 7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 2QEG | 0.75 | |
7GU | 7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | B | 1U1M | 0.75 | |
3L1 | (2S,3R,5S)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A | 2ZI4 | 0.72 | |
3L1 | (2S,3R,5S)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C,D | 2ZI5 | 0.72 | |
5I5 | 7-(5-DEOXY-BETA-D-RIBOFURANOSYL)- 5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN- 4-AMINE | A,B,C,D | 2I6A | 0.88 | |
PR5 | B | 2DD2 | 0.72 | ||
PR5 | B | 2DD1 | 0.72 | ||
PR5 | B | 2DD3 | 0.72 | ||
PR5 | A,B,C,D,E,F, G,H | 2B3J | 0.72 | ||
3AD | 3'-DEOXYADENOSINE | A,B | 3B4B | 0.71 | |
3AD | 3'-DEOXYADENOSINE | A,B | 3B4C | 0.71 | |
3AD | 3'-DEOXYADENOSINE | A,B | 1FA0 | 0.71 | |
XAE | 3-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-3H-IMIDAZO[4,5- G]QUINAZOLIN-8-AMINE | A,B | 2ICZ | 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 | |
A1P | 9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]- BETA-L-ERYTHRO-PENTOFURANOSYL}- 9H-PURIN-2-AMINE | A,C,D | 2C7O | 0.74 | |
A1P | 9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]- BETA-L-ERYTHRO-PENTOFURANOSYL}- 9H-PURIN-2-AMINE | A,C | 2C7P | 0.74 | |
A1P | 9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]- BETA-L-ERYTHRO-PENTOFURANOSYL}- 9H-PURIN-2-AMINE | A,C,D | 2C7R | 0.74 | |
A1P | 9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]- BETA-L-ERYTHRO-PENTOFURANOSYL}- 9H-PURIN-2-AMINE | A,C | 2C7Q | 0.74 | |
AD3 | 3-DEAZA-ADENOSINE | A,B | 1KIE | 0.78 | |
AD3 | 3-DEAZA-ADENOSINE | A,B,C,D | 2ZIZ | 0.78 | |
AD3 | 3-DEAZA-ADENOSINE | A,B | 1R4F | 0.78 | |
AD3 | 3-DEAZA-ADENOSINE | A,B | 1HP0 | 0.78 | |
SND | THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE | A,B,C,D | 1IHX | 0.73 | |
SND | THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE | A,B,C | 1PTJ | 0.73 | |
MTU | 9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE | A,C | 1T0D | 0.73 | |
MTU | 9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE | B,D | 2BCY | 0.73 | |
MTU | 9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE | A,B,C | 3BBI | 0.73 | |
MTU | 9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE | A,B,C | 3B91 | 0.73 | |
5ID | (2R,3R,4S,5R)-2-(4-AMINO-5-IODO- 7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)- 5-(HYDROXYMETHYL)TETRAHYDROFURAN- 3,4-DIOL | A,B | 2ZOQ | 0.9 | |
5ID | (2R,3R,4S,5R)-2-(4-AMINO-5-IODO- 7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)- 5-(HYDROXYMETHYL)TETRAHYDROFURAN- 3,4-DIOL | A | 2VUW | 0.9 | |
5ID | (2R,3R,4S,5R)-2-(4-AMINO-5-IODO- 7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)- 5-(HYDROXYMETHYL)TETRAHYDROFURAN- 3,4-DIOL | A,B,C,D | 2C47 | 0.9 | |
DBM | 9-(6-DEOXY-BETA-D-ALLOFURANOSYL)- 6-METHYLPURINE | A,B,C | 1OV6 | 0.71 | |
7RA | 7-ALPHA-D-RIBOFURANOSYL-2-AMINOPURINE- 5'-PHOSPHATE | A | 1L5M | 0.73 | |
PRN | B | 1CL8 | 0.73 | ||
PRN | B | 1U1L | 0.73 | ||
PRN | B | 1U1N | 0.73 | ||
TAL | 9-(6-DEOXY-ALPHA-L-TALOFURANOSYL)- 6-METHYLPURINE | A,B,C | 1OUM | 0.71 | |
CL9 | 2-chloro-2'-deoxyadenosine | A,B | 2ZIA | 0.71 | |
CL9 | 2-chloro-2'-deoxyadenosine | A,B | 2ZI9 | 0.71 | |
7RP | 7-ALPHA-D-RIBOFURANOSYL-PURINE- 5'-PHOSPHATE | A | 1L5L | 0.72 | |
2FD | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A,B,C | 3GGS | 0.71 | |
2FD | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A | 1Z34 | 0.71 | |
2FD | 5-(6-AMINO-2-FLUORO-PURIN-9-YL)- 2-HYDROXYMETHYL-TETRAHYDRO-FURAN- 3-OL | A,B,C | 1PKE | 0.71 | |
P5P | A,B | 1MV6 | 0.72 | ||
P5P | A,B | 1MV1 | 0.72 | ||
P5P | A,B | 1MV2 | 0.72 | ||
P5P | B | 1XV0 | 0.72 | ||
P5P | A | 1RBN | 0.72 | ||
3D1 | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C | 1S2G | 0.72 | |
3D1 | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C | 2C5H | 0.72 | |
3D1 | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B | 2Z3M | 0.72 | |
3D1 | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B,C,D | 2ZI6 | 0.72 | |
3D1 | (2R,3S,5R)-5-(6-amino-9H-purin- 9-yl)-tetrahydro-2-(hydroxymethyl)furan- 3-ol | A,B | 2ZI3 | 0.72 | |
NDA | 3-AMINOMETHYL-PYRIDINIUM-ADENINE- DINUCLEOTIDE | A,B,C,D | 1EBU | 0.74 | |
TBN | '2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN- 7-YL)-5-HYDROXYMETHYL-TETRAHYDRO- FURAN-3,4-DIOL | A,B,C | 1PR5 | 0.96 | |
MTH | 2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN- 7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO- FURAN-3,4-DIOL | A,B | 2QTG | 0.89 | |
MTH | 2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN- 7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO- FURAN-3,4-DIOL | A,B | 1NC1 | 0.89 | |
MTH | 2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN- 7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO- FURAN-3,4-DIOL | A | 1SD2 | 0.89 |