Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.33 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8663219 | 0.74 | PNMT (0.36) | PNMTCYSLTR2CYSLTR1DRD2DRD4 | |
| Hydrochloric Acid SCHEMBL8669023 | 0.69 | PNMT (0.34) | PNMTCYSLTR2CYSLTR1 | |
| Hydrochloric Acid SCHEMBL8669031 | 0.69 | PNMT (0.34) | PNMTCYSLTR2CYSLTR1DRD2DRD4 | |
| SCHEMBL8663891 | 0.69 | CYSLTR2 (0.43) | PNMTCYSLTR2CYSLTR1DRD2DRD4 | |
| SCHEMBL8663871 | 0.68 | PNMT (0.35) | PNMTCYSLTR2CYSLTR1DRD2DRD4 | |
| SCHEMBL8662797 | 0.68 | DRD2 (0.43) | PNMTCYSLTR2CYSLTR1DRD2DRD4 | |
| SCHEMBL6674622 | 0.67 | PNMT (0.66) | PNMTDRD2DRD4DRD3NPC1 | |
| SCHEMBL6676505 | 0.67 | PNMT (0.66) | PNMTDRD2DRD4DRD3NPC1 | |
| SCHEMBL8663258 | 0.67 | ALDH1A1 (0.45) | DRD2NPC1RAB9A | |
| SCHEMBL6675794 | 0.66 | PNMT (0.68) | PNMTDRD2DRD4DRD3NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5744666-A | Process for preparing an alkynyl fulvene group containing compound and said compound | PHILLIPS PETROLEUM COMPANY (US) | 1998-04-28 | — | — | US | disclosed |
| US-5728908-A | Process for preparing a bridged ligand and said bridged ligand | PHILLIPS PETROLEUM COMPANY (US) | 1998-03-17 | — | — | US | disclosed |
| US-5631203-A | Metallocene compounds and preparation thereof containing terminal alkynes | PHILLIPS PETROLEUM COMPANY (US) | 1997-05-20 | — | — | US | disclosed |