Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.43 |
| ▸ | CTSG | P08311 | 1/20 | 0.43 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.39 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7290990 | 0.92 | ELANE (0.43) | ELANECTSGPRTN3NPSR1ALDH1A1 | |
| SCHEMBL7287349 | 0.71 | MAPT (0.41) | ELANECTSGPRTN3NPSR1ALDH1A1 | |
| SCHEMBL7288574 | 0.70 | ALDH1A1 (0.44) | ELANECTSGPRTN3ALDH1A1ALDH2 | |
| SCHEMBL7288496 | 0.70 | GRM2 (0.40) | ELANECTSGPRTN3TDP1SCN9A | |
| SCHEMBL7281540 | 0.69 | NLRP3 (0.41) | ALDH1A1CYP2C19MEN1CYP3A4HTT | |
| SCHEMBL7291581 | 0.69 | SCN9A (0.43) | NPSR1ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL7280877 | 0.69 | ALDH1A1 (0.40) | ELANECTSGPRTN3ALDH1A1ALDH2 | |
| SCHEMBL7288565 | 0.68 | ALDH1A1 (0.44) | ALDH1A1ALDH2ALDH3A1MEN1KMT2A | |
| SCHEMBL7288360 | 0.67 | MEN1 (0.46) | ALDH1A1ALDH2ALDH3A1MEN1HTT | |
| SCHEMBL9485099 | 0.67 | NOTUM (0.38) | ELANECTSGPRTN3ALDH1A1MEN1 |
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-0313393-B1 | Benzoxazine compounds and pharmaceutical use thereof | YOSHITOMI PHARMACEUTICAL (JP) | 1994-03-16 | — | — | EP | disclosed |
| US-4892872-A | ANTIEMETICS, ANTINAUSEA | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-01-09 | — | — | US | disclosed |
| EP-0313393-A2 | Benzoxazine compounds and pharmaceutical use thereof | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1989-04-26 | — | — | EP | disclosed |