Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03168530
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 |
M01 | 1-[1-(9H-purin-6-yl)piperidin-4- yl]methanamine | A | 2VNW | 0.71 | |
ADE | ADENINE | A | 1WEI | 0.7 | |
ADE | ADENINE | A | 2QLU | 0.7 | |
ADE | ADENINE | A,B | 2H8G | 0.7 | |
ADE | ADENINE | A,B | 1HQC | 0.7 | |
ADE | ADENINE | A | 1AHA | 0.7 | |
ADE | ADENINE | A,B,C,D,E,F, G,H | 1BJQ | 0.7 | |
ADE | ADENINE | A,B,D | 1YXM | 0.7 | |
ADE | ADENINE | A | 1CB0 | 0.7 | |
ADE | ADENINE | A,B | 2QTT | 0.7 | |
ADE | ADENINE | A,B,C | 1XE8 | 0.7 | |
ADE | ADENINE | A,B | 1M2T | 0.7 | |
ADE | ADENINE | A | 2P8N | 0.7 | |
ADE | ADENINE | A,B,C | 2PQJ | 0.7 | |
ADE | ADENINE | A,B,C | 1VRL | 0.7 | |
ADE | ADENINE | A,B | 3BSF | 0.7 | |
ADE | ADENINE | X | 1Y26 | 0.7 | |
ADE | ADENINE | A,B | 1ZN7 | 0.7 | |
ADE | ADENINE | A,B | 1Z5N | 0.7 | |
ADE | ADENINE | A | 1QB7 | 0.7 | |
ADE | ADENINE | A | 1LU1 | 0.7 | |
ADE | ADENINE | A,B | 1Q8Y | 0.7 | |
ADE | ADENINE | A | 2QES | 0.7 | |
ADE | ADENINE | A | 2PUB | 0.7 | |
ADE | ADENINE | A | 1Z8D | 0.7 | |
ADE | ADENINE | A | 1JH8 | 0.7 | |
ADE | ADENINE | A | 1QD2 | 0.7 | |
ADE | ADENINE | A | 2ICS | 0.7 | |
ADE | ADENINE | A | 1IFS | 0.7 | |
ADE | ADENINE | A | 1NLI | 0.7 | |
ADE | ADENINE | A,B | 1D2A | 0.7 | |
ADE | ADENINE | A | 1GIU | 0.7 | |
ADE | ADENINE | A | 1J1R | 0.7 | |
ADE | ADENINE | A | 2QET | 0.7 | |
ADE | ADENINE | A,B,C | 1OD4 | 0.7 | |
ADE | ADENINE | A,B | 1QCI | 0.7 | |
ADE | ADENINE | A,B,C,D,E,F | 2GA4 | 0.7 | |
ADE | ADENINE | A,B | 1JYS | 0.7 | |
ADE | ADENINE | A | 1LPD | 0.7 | |
ADE | ADENINE | A,B | 1OD2 | 0.7 | |
ADE | ADENINE | A | 1WTA | 0.7 | |
ADE | ADENINE | A,B,C | 1S2D | 0.7 | |
ADE | ADENINE | A | 1MUD | 0.7 | |
ADE | ADENINE | A | 2PUE | 0.7 | |
AHN | N-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDE | A,B | 2AFW | 0.71 | |
HA8 | N6-(buta-2,3-dienyl)adenine | A | 3C0P | 0.72 | |
301 | N6-(penta-2,3-dienyl)adenine | A | 3BW7 | 0.75 | |
9DA | 9-DEAZAADENINE | A | 1L1R | 0.7 | |
9DA | 9-DEAZAADENINE | A | 1L1Q | 0.7 | |
ZIP | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 1W1Q | 0.73 | |
ZIP | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 2EXM | 0.73 | |
M02 | 1-(9H-purin-6-yl)piperidin-4-amine | A | 2VNY | 0.75 | |
HSM | HISTAMINE | A,B | 1U18 | 0.75 | |
HSM | HISTAMINE | A | 1AVN | 0.75 | |
HSM | HISTAMINE | A,B | 1KAR | 0.75 | |
HSM | HISTAMINE | A,B | 1NP1 | 0.75 | |
HSM | HISTAMINE | A,B | 1JQD | 0.75 | |
HSM | HISTAMINE | A,B | 2QEB | 0.75 | |
HSM | HISTAMINE | A,B | 1QFV | 0.75 | |
HSM | HISTAMINE | A | 1IKE | 0.75 | |
HSM | HISTAMINE | A | 3BU1 | 0.75 | |
HSM | HISTAMINE | A,B | 1QFT | 0.75 | |
6MP | 6-METHYLPURINE | A,B,C | 1OU4 | 0.78 | |
6MP | 6-METHYLPURINE | A,B,C | 1OTY | 0.78 | |
6MP | 6-METHYLPURINE | A | 2PUA | 0.78 | |
3MA | 6-AMINO-3-METHYLPURINE | A | 3MAG | 0.71 | |
M1A | 6-AMINO-1-METHYLPURINE | A | 1B42 | 0.71 | |
6AP | 9H-PURINE-2,6-DIAMINE | A | 2B57 | 0.7 | |
BZI | BENZIMIDAZOLE | A | 1RYC | 0.72 | |
BZI | BENZIMIDAZOLE | A | 1L5F | 0.72 | |
BZI | BENZIMIDAZOLE | A | 1KXM | 0.72 |