Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7708215 | 0.91 | PARP1 (0.42) | PARP1HSD17B10ALOX15ALDH1A1USP2 | |
| SCHEMBL7711006 | 0.90 | PARP1 (0.36) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL6302996 | 0.90 | PARP1 (0.43) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL7713425 | 0.90 | PARP1 (0.44) | PARP1HSD17B10ALOX15SMYD3USP2 | |
| SCHEMBL7713376 | 0.90 | PARP1 (0.56) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL7708088 | 0.89 | PARP1 (0.47) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL7713340 | 0.89 | PARP1 (0.47) | PARP1HSD17B10ALOX15ALDH1A1SMYD3 | |
| SCHEMBL7710782 | 0.88 | PARP1 (0.44) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL6308969 | 0.88 | PARP1 (0.46) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL7711139 | 0.88 | PARP1 (0.48) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |