Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02936796
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 |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.84 |  |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.74 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.71 | |
AAS | 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE | A | 1CZM | 0.82 | |
LJG | N,N'-(iminodiethane-2,1-diyl)bis[4- amino-N-(2-methylpropyl)benzenesulfonamide] | B | 3BGB | 0.76 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.73 | |
| 3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.73 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.78 | |
I7B | 4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDE | A | 2POV | 0.72 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.85 | |
I7C | 4-AMINO-6-(TRIFLUOROMETHYL)BENZENE- 1,3-DISULFONAMIDE | A | 2POW | 0.73 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.74 | |
| PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.74 | |
OSP | SULTHIAME | A | 2Q1Q | 0.73 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.73 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.74 | |
| NIN | DINITROPHENYLENE | A | 1GVY | 0.74 | |
| NIN | DINITROPHENYLENE | A | 1GW1 | 0.74 | |
3CZ | (2R)-1-[(4-tert-butylphenyl)sulfonyl]- 2-methyl-4-(4-nitrophenyl)piperazine | A,B | 3CZR | 0.71 | |
UA5 | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.7 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.74 | |
| NBZ | NITROBENZENE | A,B | 3BGU | 0.74 | |
SG1 | 3-NITRO-4-(2-OXO-PYRROLIDIN-1-YL)- BENZENESULFONAMIDE | A | 1KWQ | 0.7 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.78 | |
| NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.78 | |
| NIT | 4-NITROANILINE | B | 1VBS | 0.78 | |
| NIT | 4-NITROANILINE | C | 1V9T | 0.78 | |
| NIT | 4-NITROANILINE | C,D | 1VBT | 0.78 | |
| NIT | 4-NITROANILINE | B | 1LOP | 0.78 | |
| NIT | 4-NITROANILINE | C,D | 1ZKF | 0.78 | |
| NIT | 4-NITROANILINE | B | 1PIP | 0.78 | |
PND | P-NITROPHENYLHYDRAZINE | A,G | 1JMZ | 0.72 | |
NR2 | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.72 | |
MB1 | 2-chloro-5-nitrobenzenesulfonamide | A | 2QP6 | 0.79 | |
TPY | (2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | B | 1E36 | 0.75 | |
| TPY | (2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | B | 1E37 | 0.75 | |
| TPY | (2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | B | 1E38 | 0.75 | |
SDA | 4-AMINO-3,5-DICHLOROBENZENESULFONAMIDE | A | 1ZGE | 0.7 | |
ROK | 4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDE | A,B,C,D,E,F, G,H | 2VT5 | 0.73 | |