Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02847040
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 |
G1L | 3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE | A,B | 2I80 | 0.72 |  |
NPP | N-(2-AMINO-ETHYL)-4,6-DINITRO-N'- (2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN- 4-YL)-BENZENE-1,3-DIAMINE | L | 1BAF | 0.71 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.75 | |
| 3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.75 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.72 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.78 | |
AAH | H | 1KEL | 0.71 | | |
| AAH | B,H | 1FL6 | 0.71 | | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.71 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.74 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.84 | |
| PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.84 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.74 | |
CLM | CHLORAMPHENICOL | A | 1K01 | 0.72 | |
| CLM | CHLORAMPHENICOL | 1,2,4,A,B,C, D,E,J,K,L,M, N,O,P,R,S,T, U,V,Z | 1NJI | 0.72 | |
| CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 2XAT | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 4CLA | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 1CLA | 0.72 | |
| CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 1USQ | 0.72 | |
| CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKJ | 0.72 | |
| CLM | CHLORAMPHENICOL | A,B | 2UXP | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 1QHS | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 1QHY | 0.72 | |
| CLM | CHLORAMPHENICOL | A | 3CLA | 0.72 | |
PNC | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.75 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.7 | |
NP1 | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.83 | |
HNT | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.74 | |
IDM | INDOLINE | A,B | 3CEP | 0.73 | |
| IDM | INDOLINE | A | 1AEK | 0.73 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.72 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.71 | |
| DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.71 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.73 | |
| NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.73 | |
| NIT | 4-NITROANILINE | B | 1VBS | 0.73 | |
| NIT | 4-NITROANILINE | C | 1V9T | 0.73 | |
| NIT | 4-NITROANILINE | C,D | 1VBT | 0.73 | |
| NIT | 4-NITROANILINE | B | 1LOP | 0.73 | |
| NIT | 4-NITROANILINE | C,D | 1ZKF | 0.73 | |
| NIT | 4-NITROANILINE | B | 1PIP | 0.73 | |