Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03727581
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 |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.72 |  |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.79 | |
CGQ | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B,D,E | 2G0E | 0.7 | |
| CGQ | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B | 1M6F | 0.7 | |
TPM | 2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM | J,K,L | 1F3D | 0.74 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.79 | |
| MGR | MALACHITE GREEN | A | 1Q8N | 0.79 | |
| MGR | MALACHITE GREEN | A,B | 3BR0 | 0.79 | |
| MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.79 | |
| MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.79 | |
| MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.79 | |
ZAT | 4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE) | A | 2W0J | 0.77 | |
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 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.78 | |
| DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.78 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.71 | |
MQ0 | (3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3- DIPHENYL-ALLYLIDENE)-AMINE | A,B,C | 3STD | 0.72 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.71 | |
| PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.71 | |
BRN | BERENIL | A,B | 268D | 0.78 | |
| BRN | BERENIL | A,B | 1D63 | 0.78 | |
| BRN | BERENIL | A,D,E | 2GBY | 0.78 | |
| BRN | BERENIL | A | 2DBE | 0.78 | |
| BRN | BERENIL | A | 2GVR | 0.78 | |
IXX | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.74 | |
N9H | (5S)-5-(3-AMINOPROPYL)-3-(2,5-DIFLUOROPHENYL)- N-ETHYL-5-PHENYL-4,5-DIHYDRO-1H- PYRAZOLE-1-CARBOXAMIDE | A,B | 2G1Q | 0.71 | |
L15 | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.71 | |
666 | 6-(4-{[2-(3-IODOBENZYL)-3-OXOCYCLOHEX- 1-EN-1-YL]AMINO}PHENYL)-5-METHYL- 4,5-DIHYDROPYRIDAZIN-3(2H)-ONE | A,B,C,D | 1SO2 | 0.72 | |
L02 | 4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL- 5-YL]PIPERIDINE | B,I | 1WAY | 0.74 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.79 | |
GVG | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.71 | |
R20 | 4-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLE | A | 2ADU | 0.7 | |