Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4337065 | 1.00 | SMN1; SMN2 (0.42) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL791252 | 0.98 | ALDH1A1 (0.43) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL4325783 | 0.96 | ALDH1A1 (0.42) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL4953807 | 0.96 | ALDH1A1 (0.42) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL4325752 | 0.94 | SMN1; SMN2 (0.44) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL7991224 | 0.94 | SMN1; SMN2 (0.44) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL7991219 | 0.94 | SMN1; SMN2 (0.44) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL7485551 | 0.92 | ALDH1A1 (0.37) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL4333124 | 0.92 | ALDH1A1 (0.44) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 | |
| SCHEMBL4954390 | 0.90 | ALDH1A1 (0.36) | SMN1; SMN2ALOX15ALDH1A1USP2NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009145357-A1 | IN 1-POSITION DURCH EINEN RING SUBSTITUIERTE BENZO [1, 4] DIAZEPINE ZUR VERWENDUNGS ALS ANTIDEPRESSIVA | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2009-12-03 | — | — | WO | disclosed |