Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ALPG | P10696 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8973683 | 0.93 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL8973693 | 0.89 | CYP19A1 (0.57) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL7569216 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL9638940 | 0.87 | ALDH1A1 (0.56) | ALDH1A1HPGDKMT2AMEN1CYP1A2 | |
| SCHEMBL8973848 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL7786961 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL11572440 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL8973648 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL8973675 | 0.87 | CYP19A1 (0.60) | ALDH1A1KMT2AMAPTLMNATDP1 | |
| SCHEMBL10804895 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDKMT2AMEN1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0292985-B1 | PROCESS FOR PREPARING 2,4-DINITRO-PHENYLETHERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-03-25 | — | — | EP | disclosed |
| US-4847426-A | Process for the preparation of 2,4-dinitrophenyl ethers | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-07-11 | — | — | US | disclosed |
| EP-0292985-A1 | Process for preparing 2,4-dinitro-phenylethers | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-11-30 | — | — | EP | disclosed |