Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02988588
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 |
U12 | 5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG2 | 0.72 |  |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.75 | |
IDM | INDOLINE | A,B | 3CEP | 0.71 | |
| IDM | INDOLINE | A | 1AEK | 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 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.73 | |
| PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.73 | |
DZP | 7-CHLORO-1-METHYL-5-PHENYL-1,3- DIHYDRO-2H-1,4-BENZODIAZEPIN-2- ONE | A,B | 2BXF | 0.71 | |
BEP | 1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE | C | 1LXF | 0.73 | |
| BEP | 1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE | A | 1DTL | 0.73 | |
BRN | BERENIL | A,B | 268D | 0.72 | |
| BRN | BERENIL | A,B | 1D63 | 0.72 | |
| BRN | BERENIL | A,D,E | 2GBY | 0.72 | |
| BRN | BERENIL | A | 2DBE | 0.72 | |
| BRN | BERENIL | A | 2GVR | 0.72 | |
SII | N-(4-{[4-(cyclohexylamino)-1-(3- fluorophenyl)-2-oxo-1,3,8-triazaspiro[4.5]dec- 3-en-8-yl]methyl}phenyl)acetamide | A | 3FKT | 0.74 | |
IXX | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.75 | |
UFO | 1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine | A,B,D | 3GQT | 0.74 | |
U19 | 5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG5 | 0.72 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.78 | |
5CY | N,N'-(dipropyl)-tetramethylindodicarbocyanine | C | 3BEP | 0.7 | |
EBW | 4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}- 3-OXOPENTYL)-N,N-DIMETHYL-N-PROP- 2-ENYLBENZENAMINIUM | A | 1E3Q | 0.71 | |
TPM | 2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM | J,K,L | 1F3D | 0.79 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.78 | |
| MGR | MALACHITE GREEN | A | 1Q8N | 0.78 | |
| MGR | MALACHITE GREEN | A,B | 3BR0 | 0.78 | |
| MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.78 | |
| MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.78 | |
| MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.78 | |
DR1 | 5-METHYL-5H-INDOLO[3,2-B]QUINOLINE | A | 1K9G | 0.73 | |