Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.68 |
| ▸ | CA2 | P00918 | 4/20 | 0.68 |
| ▸ | CA9 | Q16790 | 3/20 | 0.68 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MPI | P34949 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9273922 | 1.00 | CA12 (0.68) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL1946250 | 0.88 | CA12 (0.75) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL1946252 | 0.88 | CA12 (0.75) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL11428155 | 0.86 | CA12 (0.46) | CA12CA2CA9ALDH1A1KDM4E | |
| SCHEMBL11428153 | 0.86 | CA12 (0.46) | CA12CA2CA9ALDH1A1KDM4E | |
| SCHEMBL11413806 | 0.84 | CA12 (0.64) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL11413807 | 0.84 | CA12 (0.64) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL30172528 | 0.84 | CA12 (0.64) | CA12CA2CA9SIRT2ALDH1A1 | |
| SCHEMBL30342973 | 0.83 | ALDH1A1 (0.65) | CA12CA2CA9ALDH1A1KDM4E | |
| SCHEMBL710477 | 0.82 | CA12 (1.00) | CA12CA2CA9SIRT2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5461046-A | Analgesics | G. D. SEARLE & CO. (US) | 1995-10-24 | — | — | US | disclosed |
| US-5304644-A | 1-,2-,3-,4-,5-,6-,7-,8- and/or 9 substituted dibenzoxazepine compounds, pharmaceutical compositions and methods for treating pain | G. D. SEARLE & CO. (US) | 1994-04-19 | — | — | US | disclosed |