Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ACP3 | P15309 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7588864 | 0.91 | CYP3A4 (0.44) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL15424790 | 0.82 | HTT (0.38) | CYP3A4ACP3HTTMEN1MAPT | |
| SCHEMBL4669249 | 0.78 | CYP3A4 (0.41) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL300705 | 0.76 | CYP3A4 (0.44) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL4669250 | 0.76 | CYP3A4 (0.50) | CYP3A4TRPA1ACP3 | |
| SCHEMBL23721637 | 0.76 | CYP3A4 (0.45) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL1044718 | 0.75 | CYP3A4 (0.61) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| SCHEMBL635874 | 0.74 | CYP3A4 (0.43) | CYP3A4TRPA1ALDH1A1HPGDTDP1 | |
| Toluene Diisocyanate SCHEMBL11598038 | 0.74 | CYP3A4 (0.67) | CYP3A4TRPA1TDP1HTTMEN1 | |
| SCHEMBL635875 | 0.72 | CYP3A4 (0.41) | CYP3A4TRPA1ALDH1A1HPGDTDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0332425-B1 | PROCESS FOR REFINING 1,3-DIMETHYL-2-IMIDAZOLIDINONE AND A PROCESS FOR PREPARING AN AROMATIC POLYAMIDE BY USE OF THE REFINED PRODUCT | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-01-27 | — | — | EP | disclosed |
| US-5075406-A | Solution polymerization of polyamides in solvent purified by adsorption on magnesia, alumina, silica or mixed oxides | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-12-24 | — | — | US | disclosed |
| US-5011936-A | Using composite salt consisting of at least two of silica, magnesia and alumina | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-04-30 | — | — | US | disclosed |
| US-4923951-A | DIISOCYANTE, ALKALI OR ALKALINE EARTH METAL CATALYST | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1990-05-08 | — | — | US | disclosed |
| EP-0332425-A1 | Process for refining 1,3-dimethyl-2-imidazolidinone and a process for preparing an aromatic polyamide by use of the refined product | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1989-09-13 | — | — | EP | disclosed |