Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02999087
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 |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.74 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.74 | ![]() |
NID![]() | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.86 | ![]() |
CRI![]() | A,B | 1VKG | 0.73 | ![]() | |
GW9![]() | 2-chloro-5-nitro-N-phenylbenzamide | A,D | 3E00 | 0.73 | ![]() |
NTD![]() | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.73 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.75 | ![]() |
PRQ![]() | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.7 | ![]() |
4NB![]() | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.73 | ![]() |
TNL![]() | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.7 | ![]() |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.73 | ![]() |
KY1![]() | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.7 | ![]() |
4AN![]() | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE | A | 2PAX | 0.7 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1T64 | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1C3R | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3F0R | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3C10 | 0.75 | ![]() |
4PG![]() | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.71 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.75 | ![]() |