Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.33 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL9139703 | 0.62 | HTR1A (0.41) | — | |
| SCHEMBL9409680 | 0.58 | — | — | |
| SCHEMBL2512859 | 0.57 | MAPT (0.35) | ALDH1A1 | |
| SCHEMBL8567468 | 0.57 | GSK3A (0.46) | ALDH1A1 | |
| SCHEMBL8542971 | 0.57 | — | — | |
| SCHEMBL3880356 | 0.57 | CHRM2 (0.45) | ALDH1A1MAPK1 | |
| SCHEMBL24356067 | 0.55 | LMNA (0.34) | — | |
| SCHEMBL16116451 | 0.55 | — | — | |
| SCHEMBL11726006 | 0.55 | CHRM2 (0.48) | — | |
| SCHEMBL24356068 | 0.55 | LMNA (0.34) | — |
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-0452850-B1 | 4-[3-(4-Oxothiazoldinyl)]butynylamines, a process for their preparation and their use as medicaments | HOECHST MARION ROUSSEL INC (US) | 1998-02-04 | — | — | EP | disclosed |
| EP-0452850-A1 | 4-[3-(4-Oxothiazoldinyl)]butynylamines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-10-23 | — | — | EP | disclosed |
| US-5034392-A | Analgesics or hypotensive agents | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-07-23 | — | — | US | disclosed |