Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL6302996 | 0.97 | PARP1 (0.43) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7708056 | 0.91 | PARP1 (0.47) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7713340 | 0.91 | PARP1 (0.47) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7704916 | 0.90 | HSD17B10 (0.35) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7711139 | 0.88 | PARP1 (0.48) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7713425 | 0.88 | PARP1 (0.44) | PARP1TP53POLBSMN1; SMN2HSD17B10 | |
| SCHEMBL6302723 | 0.88 | PARP1 (0.47) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL6309909 | 0.88 | HSD17B10 (0.33) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL6308969 | 0.85 | PARP1 (0.46) | PARP1TP53POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL7710782 | 0.85 | PARP1 (0.44) | PARP1TP53ALDH1A1TSHRHSD17B10 |
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 |