Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02178592
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 |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.73 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.73 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.73 | |
ANI | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.73 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.84 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.84 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.75 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.72 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.78 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.73 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.71 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.72 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.72 | |
ISO | PARA-ISOPROPYLANILINE | A | 1BMA | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.78 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.76 | |
ANC | ANTHRACEN-1-YLAMINE | A,B | 1GT1 | 0.74 | |
ANC | ANTHRACEN-1-YLAMINE | A,B | 1HN2 | 0.74 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.78 | |
9AP | 9-AMINOPHENANTHRENE | A | 1EGY | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.71 | |
HNT | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.72 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.83 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.72 | |
IDM | INDOLINE | A,B | 3CEP | 0.72 | |
IDM | INDOLINE | A | 1AEK | 0.72 |