Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL10658365 | 0.69 | CES1 (0.51) | MAP2K1HTR1A | |
| SCHEMBL9827478 | 0.67 | CES1 (0.42) | MAP2K1HTR1ALMNAHTR6 | |
| SCHEMBL9827449 | 0.64 | HTR1A (0.44) | HTR1AHTR6 | |
| SCHEMBL9828705 | 0.64 | HTR1A (0.41) | HTR1AHTR6 | |
| SCHEMBL9827268 | 0.62 | HSD17B10 (0.43) | HTR1ALMNASMN1; SMN2HTR6 | |
| SCHEMBL9827264 | 0.62 | HSD17B10 (0.43) | HTR1ALMNASMN1; SMN2HTR6 | |
| SCHEMBL9828460 | 0.61 | HTR1A (0.42) | HTR1AHTR6 | |
| SCHEMBL9074293 | 0.61 | NPC1 (0.43) | HTR1ALMNASMN1; SMN2HTR6 | |
| SCHEMBL9829765 | 0.60 | OPRM1 (0.36) | — | |
| SCHEMBL10660230 | 0.59 | HTR2A (0.43) | HTR1ALMNA |
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-0239129-B1 | HYDROQUINOLINE COMPOUNDS, COMPOSITIONS CONTAINING SAME AND PROCESSES FOR PREPARING SAME | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-09-25 | — | — | EP | disclosed |
| US-4963566-A | ANTIULCER AGENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1990-10-16 | — | — | US | disclosed |
| EP-0239129-A2 | Hydroquinoline compounds, compositions containing same and processes for preparing same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1987-09-30 | — | — | EP | disclosed |