Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11210405 | 0.86 | MAPK1 (0.46) | MAPK1POLBHPGDCA12CA9 | |
| SCHEMBL11212616 | 0.80 | MAPK1 (0.44) | MAPK1POLBHPGDCA12CA9 | |
| SCHEMBL6981532 | 0.79 | CASP3 (0.45) | MAPK1CA12CA9KMT2ACASP3 | |
| SCHEMBL13141314 | 0.76 | MAPK1 (0.46) | MAPK1POLBHPGDCA12CA9 | |
| SCHEMBL8422024 | 0.75 | MAPK1 (0.46) | MAPK1POLBHPGDCA12CA9 | |
| SCHEMBL8218019 | 0.72 | CASP3 (0.49) | MAPK1CA12CA9KMT2AHDAC1 | |
| SCHEMBL10505505 | 0.72 | GRM5 (0.45) | GSK3BCA12CA9KMT2AHDAC1 | |
| SCHEMBL31284533 | 0.71 | GSK3B (0.60) | GSK3BPOLBHPGDKMT2AMAPT | |
| SCHEMBL5642365 | 0.71 | CASP3 (0.44) | MAPK1CA12CA9KMT2ACASP3 | |
| SCHEMBL2245062 | 0.70 | GSK3B (0.58) | GSK3BPOLBHPGDKMT2AMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6090804-A | PSYCHOLOGICAL DISORDERS; SCHIZOPHRENIA THERAPY | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2000-07-18 | — | — | US | disclosed |
| EP-0921123-A1 | NOVEL THIOPHENE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1999-06-09 | — | — | EP | disclosed |