Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 4/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7711137 | 0.91 | CTSL (0.45) | CTSLALDH1A1HSD17B10CYP3A4SCN9A | |
| SCHEMBL7092472 | 0.91 | HSD17B10 (0.37) | CTSLALDH1A1HSD17B10HPGDHTT | |
| SCHEMBL7704943 | 0.91 | ALDH1A1 (0.43) | CTSLALDH1A1HSD17B10HPGDHTT | |
| SCHEMBL7090483 | 0.90 | CTSS (0.45) | CTSLALDH1A1HSD17B10SCN9AHPGD | |
| SCHEMBL7711070 | 0.90 | CACNA1B (0.40) | ALDH1A1HSD17B10HPGDHTTNPSR1 | |
| SCHEMBL7091267 | 0.89 | HSD17B10 (0.33) | CTSLALDH1A1HSD17B10HPGDHTT | |
| SCHEMBL7091516 | 0.89 | SCN9A (0.39) | ALDH1A1HSD17B10SCN9AHPGDHTT | |
| SCHEMBL7708478 | 0.88 | HSD17B10 (0.35) | CTSLALDH1A1HSD17B10HPGDHTT | |
| SCHEMBL7095517 | 0.87 | SIRT2 (0.38) | ALDH1A1HSD17B10HPGDHTTNPSR1 | |
| SCHEMBL7093383 | 0.87 | MC4R (0.41) | CTSLALDH1A1HSD17B10CYP3A4HPGD |
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 |