Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02758585
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 |
AFF | 2-ACETYLAMINOFLUORENE-3-YL | A | 2GE2 | 0.83 |  |
MI2 | 2-(2-METHYLPHENYL)-1H-INDOLE-5- CARBOXIMIDAMIDE | A | 2G8T | 0.71 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.74 | |
4AN | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE | A | 2PAX | 0.71 | |
675 | 6-[(Z)-AMINO(IMINO)METHYL]-N-PHENYL- 2-NAPHTHAMIDE | A | 1OWE | 0.73 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.75 | |
239 | 6-[(Z)-AMINO(IMINO)METHYL]-N-[4- (AMINOMETHYL)PHENYL]-2-NAPHTHAMIDE | A | 1OWH | 0.71 | |
9AP | 9-AMINOPHENANTHRENE | A | 1EGY | 0.86 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.71 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.7 | |
GA0 | GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE | A | 2DCM | 0.71 | |
ANC | ANTHRACEN-1-YLAMINE | A,B | 1GT1 | 0.85 | |
| ANC | ANTHRACEN-1-YLAMINE | A,B | 1HN2 | 0.85 | |
12B | BENZO[CD]INDOL-2(1H)-ONE | A,B | 2F67 | 0.75 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.7 | |
| XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.7 | |
ISO | PARA-ISOPROPYLANILINE | A | 1BMA | 0.72 | |
| ISO | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.72 | |
| ISO | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.72 | |
| ISO | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.72 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.71 | |
| MGR | MALACHITE GREEN | A | 1Q8N | 0.71 | |
| MGR | MALACHITE GREEN | A,B | 3BR0 | 0.71 | |
| MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.71 | |
| MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.71 | |
| MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.71 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.71 | |
IDM | INDOLINE | A,B | 3CEP | 0.75 | |
| IDM | INDOLINE | A | 1AEK | 0.75 | |
2AN | 1-ANILINO-8-NAPHTHALENE SULFONATE | A,B | 3CFN | 0.79 | |
| 2AN | 1-ANILINO-8-NAPHTHALENE SULFONATE | A,B | 2ANS | 0.79 | |
| 2AN | 1-ANILINO-8-NAPHTHALENE SULFONATE | A,B | 1OW4 | 0.79 | |
| 2AN | 1-ANILINO-8-NAPHTHALENE SULFONATE | A | 1EYN | 0.79 | |
| 2AN | 1-ANILINO-8-NAPHTHALENE SULFONATE | A,B | 1TXC | 0.79 | |
MNS | 5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDE | A | 1OKL | 0.71 | |
IXX | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.74 | |
TTT | 5-amino-2-methyl-N-[(1R)-1-naphthalen- 1-ylethyl]benzamide | A | 3E9S | 0.72 | |
OCH | QUINOLIN-2(1H)-ONE | A,B,C,D,E,F | 1Z03 | 0.7 | |
DR1 | 5-METHYL-5H-INDOLO[3,2-B]QUINOLINE | A | 1K9G | 0.73 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.76 | |
| DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.76 | |
A8B | A | 1ODC | 0.71 | |