Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01729712
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 |
427 | (R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL)PHENYL)GUANIDINE | A | 1ZMN | 0.73 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.75 | |
IET | 1-(4-CYANO-PHENYL)-3-[2-(2,6-DICHLORO- PHENYL)-1-IMINO-ETHYL]-THIOUREA | A | 1S6P | 0.71 | |
BRN | BERENIL | A,B | 268D | 0.71 | |
BRN | BERENIL | A,B | 1D63 | 0.71 | |
BRN | BERENIL | A,D,E | 2GBY | 0.71 | |
BRN | BERENIL | A | 2DBE | 0.71 | |
BRN | BERENIL | A | 2GVR | 0.71 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.7 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.7 | |
1JZ | 1-[4-(hydroxymethyl)phenyl]guanidine | B | 3FVF | 0.75 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.72 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.71 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.76 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.76 | |
GP6 | 1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA | A | 1BJU | 0.75 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.73 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.76 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.77 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.77 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.77 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.77 | |
G1L | 3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE | A,B | 2I80 | 0.73 | |
IDM | INDOLINE | A,B | 3CEP | 0.75 | |
IDM | INDOLINE | A | 1AEK | 0.75 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.71 | |
AGB | N-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREA | A | 1EJN | 0.74 | |
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 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.71 |