Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4242108 | 0.99 | PKM (0.34) | PKMMAPTALDH1A1NPSR1LMNA | |
| SCHEMBL1031181 | 0.90 | PIK3C3 (0.41) | PKMMAPTALDH1A1NPSR1LMNA | |
| SCHEMBL1031521 | 0.90 | PKM (0.35) | PKMMAPTALDH1A1NPSR1LMNA | |
| Hydrochloric Acid SCHEMBL4243272 | 0.89 | PIK3C3 (0.40) | PKMMAPTALDH1A1NPSR1LMNA | |
| Hydrochloric Acid SCHEMBL4252359 | 0.89 | PKM (0.35) | PKMMAPTALDH1A1NPSR1LMNA | |
| SCHEMBL1029088 | 0.85 | PKM (0.41) | PKMMAPTALDH1A1NPSR1LMNA | |
| Hydrochloric Acid SCHEMBL4250907 | 0.84 | PKM (0.40) | PKMMAPTALDH1A1NPSR1LMNA | |
| SCHEMBL1028955 | 0.84 | TRPV1 (0.35) | PKMMAPTLMNATSHRHTT | |
| Hydrochloric Acid SCHEMBL4241867 | 0.83 | TRPV1 (0.34) | PKMMAPTLMNATSHRHTT | |
| SCHEMBL1031369 | 0.82 | FFAR4 (0.48) | PKMALDH1A1LMNATSHRHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2013179-B1 | ARYLOXYETHYLAMINE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | ABBOTT GMBH & CO KG (DE) | 2011-01-19 | — | — | EP | disclosed |