Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02294705
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 |
TFM | S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA | A,B | 1K2U | 0.78 | |
ANL | ANILINE | A | 2OV4 | 0.77 | |
ANL | ANILINE | A | 1AEE | 0.77 | |
ANL | ANILINE | A | 1PPA | 0.77 | |
ANL | ANILINE | A | 1HJ9 | 0.77 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.7 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.72 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.72 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.74 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.71 | |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.72 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.75 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.73 | |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.71 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.89 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.89 | |
PHZ | 1-PHENYLHYDRAZINE | A | 2E2T | 0.71 | |
PHZ | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.71 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.75 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.71 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.71 | |
NBE | NITROSOBENZENE | A | 1LH7 | 0.75 | |
NBE | NITROSOBENZENE | A | 2LH7 | 0.75 | |
NBE | NITROSOBENZENE | A | 2NSS | 0.75 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.7 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.7 |