Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02578044
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 |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.74 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.74 | ![]() |
5BM![]() | (2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrile | A | 3EQH | 0.79 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.75 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.72 | ![]() |
IXX![]() | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.71 | ![]() |
URS![]() | N-PHENYLTHIOUREA | A,B | 1BUG | 0.73 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.75 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 3E85 | 0.74 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 2ZJF | 0.74 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.78 | ![]() |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.72 | ![]() |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.72 | ![]() |
171![]() | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.72 | ![]() |
FTA![]() | 3-(4-PHENYLAMINO-PHENYLAMINO)-2- (1H-TETRAZOL-5-YL)-ACRYLONITRILE | A | 1PZP | 0.73 | ![]() |
PL0![]() | 1-phenylguanidine | A | 2O8W | 0.7 | ![]() |