Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02817362
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 |
39A | 6-AMINO-3,9-DIMETHYL-9H-PURIN-3- IUM | A,B | 1PU7 | 0.77 | |
P1R | PYRIMIDINE | X | 2GTF | 0.78 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B | 1JXI | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B | 1TO9 | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B | 2Q4X | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B | 3EPM | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B,C,D | 1YAK | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B,C,D | 2GM8 | 0.71 | |
HMH | 4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINE | A,B | 2F2G | 0.71 | |
LG3 | PYRIMIDINE-2,4-DIAMINE | A | 2EUN | 0.85 | |
ADK | 3-METHYL-3H-PURIN-6-YLAMINE | A,B | 2OFI | 0.74 | |
ADK | 3-METHYL-3H-PURIN-6-YLAMINE | A | 1P7M | 0.74 | |
LGA | PYRIMIDIN-2-AMINE | A | 2JJC | 0.8 | |
MXD | 6-PIPERIDIN-1-YLPYRIMIDINE-2,4- DIAMINE 3-OXIDE | A,B | 3B6H | 0.71 | |
ZIP | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 1W1Q | 0.72 | |
ZIP | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 2EXM | 0.72 | |
YF3 | 2-{[(4-AMINO-2-METHYLPYRIMIDIN- 5-YL)METHYL]AMINO}PROPANE-1-THIOL | A,B | 1T9A | 0.75 | |
YF3 | 2-{[(4-AMINO-2-METHYLPYRIMIDIN- 5-YL)METHYL]AMINO}PROPANE-1-THIOL | A,B | 1T9B | 0.75 | |
6AP | 9H-PURINE-2,6-DIAMINE | A | 2B57 | 0.71 | |
2BP | 9H-purin-2-amine | A | 3G4M | 0.79 | |
3MA | 6-AMINO-3-METHYLPURINE | A | 3MAG | 0.73 | |
YF1 | 2,5-DIMETHYLPYRIMIDIN-4-AMINE | A,B,C,D | 1T9D | 0.81 | |
572 | 4-[2-(HYDROXYMETHYL)PYRIMIDIN-4- YL]-N,N-DIMETHYLPIPERAZINE-1-SULFONAMIDE | A,B,C,D | 1PL6 | 0.71 | |
PF1 | N-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-N-(2-HYDROXYETHYL)FORMAMIDE | A,B | 2QCX | 0.7 | |
M1A | 6-AMINO-1-METHYLPURINE | A | 1B42 | 0.73 | |
L21 | 3-(3-methylbut-2-en-1-yl)-3H-purin- 6-amine | A,B | 2W6Z | 0.72 | |
EA1 | 3H-IMIDAZO[2,1-I]PURINE | A,B | 1PU8 | 0.73 | |
3AY | PYRIMIDINE-2,4,6-TRIAMINE | A | 2G9C | 0.74 | |
3AY | PYRIMIDINE-2,4,6-TRIAMINE | X | 2RBX | 0.74 | |
NSP | 5-(AMINOMETHYL)-2-METHYLPYRIMIDIN- 4-AMINE | A,B | 1T9B | 0.81 | |
NSP | 5-(AMINOMETHYL)-2-METHYLPYRIMIDIN- 4-AMINE | I | 1E80 | 0.81 | |
PYD | 2,5-DIMETHYL-PYRIMIDIN-4-YLAMINE | A | 4THI | 0.81 | |
ADE | ADENINE | A | 1WEI | 0.71 | |
ADE | ADENINE | A | 2QLU | 0.71 | |
ADE | ADENINE | A,B | 2H8G | 0.71 | |
ADE | ADENINE | A,B | 1HQC | 0.71 | |
ADE | ADENINE | A | 1AHA | 0.71 | |
ADE | ADENINE | A,B,C,D,E,F, G,H | 1BJQ | 0.71 | |
ADE | ADENINE | A,B,D | 1YXM | 0.71 | |
ADE | ADENINE | A | 1CB0 | 0.71 | |
ADE | ADENINE | A,B | 2QTT | 0.71 | |
ADE | ADENINE | A,B,C | 1XE8 | 0.71 | |
ADE | ADENINE | A,B | 1M2T | 0.71 | |
ADE | ADENINE | A | 2P8N | 0.71 | |
ADE | ADENINE | A,B,C | 2PQJ | 0.71 | |
ADE | ADENINE | A,B,C | 1VRL | 0.71 | |
ADE | ADENINE | A,B | 3BSF | 0.71 | |
ADE | ADENINE | X | 1Y26 | 0.71 | |
ADE | ADENINE | A,B | 1ZN7 | 0.71 | |
ADE | ADENINE | A,B | 1Z5N | 0.71 | |
ADE | ADENINE | A | 1QB7 | 0.71 | |
ADE | ADENINE | A | 1LU1 | 0.71 | |
ADE | ADENINE | A,B | 1Q8Y | 0.71 | |
ADE | ADENINE | A | 2QES | 0.71 | |
ADE | ADENINE | A | 2PUB | 0.71 | |
ADE | ADENINE | A | 1Z8D | 0.71 | |
ADE | ADENINE | A | 1JH8 | 0.71 | |
ADE | ADENINE | A | 1QD2 | 0.71 | |
ADE | ADENINE | A | 2ICS | 0.71 | |
ADE | ADENINE | A | 1IFS | 0.71 | |
ADE | ADENINE | A | 1NLI | 0.71 | |
ADE | ADENINE | A,B | 1D2A | 0.71 | |
ADE | ADENINE | A | 1GIU | 0.71 | |
ADE | ADENINE | A | 1J1R | 0.71 | |
ADE | ADENINE | A | 2QET | 0.71 | |
ADE | ADENINE | A,B,C | 1OD4 | 0.71 | |
ADE | ADENINE | A,B | 1QCI | 0.71 | |
ADE | ADENINE | A,B,C,D,E,F | 2GA4 | 0.71 | |
ADE | ADENINE | A,B | 1JYS | 0.71 | |
ADE | ADENINE | A | 1LPD | 0.71 | |
ADE | ADENINE | A,B | 1OD2 | 0.71 | |
ADE | ADENINE | A | 1WTA | 0.71 | |
ADE | ADENINE | A,B,C | 1S2D | 0.71 | |
ADE | ADENINE | A | 1MUD | 0.71 | |
ADE | ADENINE | A | 2PUE | 0.71 | |
ADZ | 9-METHYL-9H-PURIN-6-AMINE | A | 1O9U | 0.76 | |
YF4 | 5-{[ETHYL(METHYL)AMINO]METHYL}- 2-METHYL-5,6-DIHYDROPYRIMIDIN-4- AMINE | A,B | 1T9A | 0.81 | |
DX3 | 6,7,7-trimethyl-7,8-dihydropteridine- 2,4-diamine | A,B,C,D | 3BMF | 0.71 | |
HA8 | N6-(buta-2,3-dienyl)adenine | A | 3C0P | 0.71 |