Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004946
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 |
PH3 | N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE | A,B | 1DM6 | 0.73 | |
CLU | 2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINE | A,B,D,E | 2PNC | 0.72 | |
I7B | 4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDE | A | 2POV | 0.72 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.72 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.72 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.79 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.71 | |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.78 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.71 | |
PHZ | 1-PHENYLHYDRAZINE | A | 2E2T | 0.75 | |
PHZ | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.75 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.72 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.72 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.72 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.72 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.79 | |
C2A | 1-(3-CHLOROPHENYL)METHANAMINE | B,I | 2C8Z | 0.7 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.72 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.72 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.72 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.72 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.72 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.72 | |
2CM | 2-CHLORO-6-METHYL-ANILINE | A | 1OVH | 0.81 | |
SDA | 4-AMINO-3,5-DICHLOROBENZENESULFONAMIDE | A | 1ZGE | 0.75 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
ANL | ANILINE | A | 2OV4 | 0.83 | |
ANL | ANILINE | A | 1AEE | 0.83 | |
ANL | ANILINE | A | 1PPA | 0.83 | |
ANL | ANILINE | A | 1HJ9 | 0.83 | |
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 | |
C2B | 1-(4-CHLOROPHENYL)METHANAMINE | D,H | 2Q7Q | 0.7 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.7 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.7 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.8 |