Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02302948
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 |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.77 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.78 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.74 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.72 | |
BAN | HONH-BENZYLMALONYL-L-ALANYLGLYCINE- P-NITROANILIDE | A | 5TLN | 0.73 | |
DPK | DEPRENYL | A,B | 2BYB | 0.71 | |
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 | |
CLC | N-ACETYL-P-NITROPHENYLSERINOL | A | 1GRR | 0.73 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.77 | |
AAH | H | 1KEL | 0.73 | ||
AAH | B,H | 1FL6 | 0.73 | ||
264 | (phenylamino)acetonitrile | A | 2RBN | 0.73 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.71 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.7 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.72 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.79 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.81 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.81 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.76 | |
3CZ | (2R)-1-[(4-tert-butylphenyl)sulfonyl]- 2-methyl-4-(4-nitrophenyl)piperazine | A,B | 3CZR | 0.7 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | E,F,G,H | 1NJU | 0.71 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | Y,Z | 1JQ7 | 0.71 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | C | 1NKM | 0.71 |