Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 1.00 |
| ▸ | HPGD | P15428 | 5/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.70 |
| ▸ | MEN1 | O00255 | 1/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3952458 | 0.84 | ALDH1A1 (0.77) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL18448724 | 0.83 | KDM4E (0.71) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL30352430 | 0.83 | KDM4E (0.71) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL4141061 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL3956196 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL23780412 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL14075916 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL3953451 | 0.82 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL3956255 | 0.81 | ALDH1A1 (0.68) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL29999485 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KDM4EHPGDKMT2AMEN1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024155555-A1 | NEUROPROTECTIVE COMPOUNDS FOR THERAPEUTIC USE | NIMML INSTITUTE (US) | 2024-07-25 | — | — | WO | disclosed |
| WO-2009029617-A1 | DIARYLAMINE-SUBSTITUTED QUINOLONES USEFUL AS INDUCIBLE NITRIC OXIDE SYNTHASE INHIBITORS | KALYPSYS, INC. (US) | 2009-03-05 | — | — | WO | disclosed |
| EP-0124155-B1 | PYRAZINE COMPOUNDS, THEIR PREPARATION AND THEIR USE, COMPOSITIONS CONTAINING THEM AND METHOD OF COMBATING UNDESIRED PLANT GROWTH | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-06-03 | — | — | EP | disclosed |
| EP-0124155-A1 | Pyrazine compounds, their preparation and their use, compositions containing them and method of combating undesired plant growth | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1984-11-07 | — | — | EP | disclosed |
| US-4441912-A | N-Pyrazinyl-N-benzylcarbamates, having fungicidal and plant growth regulating properties | SHELL OIL COMPANY (US) | 1984-04-10 | — | — | US | disclosed |
| US-4359576-A | N-Pyrazinyl-N-benzylcarbamates, having fungicidal and plant growth regulating properties | SHELL OIL COMPANY (US) | 1982-11-16 | — | — | US | disclosed |