Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL24417902 | 0.84 | ALDH1A1 (0.32) | PTK2ALDH1A1TSHRCYP3A4TP53 | |
| SCHEMBL28770844 | 0.79 | PTK2 (0.38) | PTK2GAA | |
| Hydrochloric Acid SCHEMBL28981675 | 0.76 | PTK2 (0.35) | PTK2 | |
| SCHEMBL21159438 | 0.73 | ALDH1A1 (0.47) | PTK2ALDH1A1TSHRCYP3A4TP53 | |
| SCHEMBL24418015 | 0.72 | KDM4E (0.59) | ALDH1A1CYP3A4CASP1GAAMAPT | |
| SCHEMBL62068 | 0.67 | KDM4E (0.45) | ALDH1A1TSHRCYP3A4CASP1KDM4E | |
| SCHEMBL2927013 | 0.67 | CYP3A4 (0.58) | ALDH1A1TSHRCYP3A4TP53CASP1 | |
| SCHEMBL24418016 | 0.67 | PTK2 (0.41) | PTK2ALDH1A1TSHRCYP3A4TP53 | |
| SCHEMBL9403002 | 0.67 | PTK2 (0.40) | PTK2ALDH1A1TSHRCYP3A4TP53 | |
| SCHEMBL62349 | 0.67 | — | — |
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-0470514-B1 | Carbostyril derivatives and pharmaceutical composition containing the same | OTSUKA PHARMA CO LTD (JP) | 1997-02-19 | — | — | EP | disclosed |
| US-5300513-A | Vasopressin antagonists; vasodilators, hypotensive agents, water diuretics, and platelet agglutination inhibitors | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-04-05 | — | — | US | disclosed |
| EP-0470514-A1 | Carbostyril derivatives and pharmaceutical composition containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-02-12 | — | — | EP | disclosed |