Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 3/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7699846 | 0.83 | TSHR (0.46) | ALDH1A1KDM4EHTTSMN1; SMN2HSD17B10 | |
| SCHEMBL7702968 | 0.81 | TSHR (0.41) | ALDH1A1KDM4ESMN1; SMN2HSD17B10L3MBTL1 | |
| Hydrochloric Acid SCHEMBL7696598 | 0.81 | RAD52 (0.38) | ALDH1A1KDM4EHTTSMN1; SMN2RAD52 | |
| Hydrochloric Acid SCHEMBL7696592 | 0.81 | RAD52 (0.39) | ALDH1A1KDM4EHTTSMN1; SMN2RAD52 | |
| SCHEMBL7702347 | 0.80 | PARP1 (0.50) | ALDH1A1SMN1; SMN2HSD17B10L3MBTL1 | |
| SCHEMBL7385304 | 0.77 | MAPT (0.39) | ALDH1A1KDM4EHTTL3MBTL1TP53 | |
| SCHEMBL7696668 | 0.76 | CA12 (0.48) | ALDH1A1HSD17B10TP53 | |
| SCHEMBL7386364 | 0.75 | CA12 (0.37) | ALDH1A1KDM4EHSD17B10L3MBTL1TP53 | |
| SCHEMBL7385154 | 0.75 | ALDH1A1 (0.43) | ALDH1A1KDM4ESMN1; SMN2HSD17B10L3MBTL1 | |
| SCHEMBL7698997 | 0.75 | CYP4F2 (0.41) | ALDH1A1TP53 |
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-6346527-B1 | 1-BENZOXEPIN DERIVATIVES USED IN THE PREVENTION OF SODIUM AND HYDROGEN ION EXCHANGE; CARDIOVASCULAR, KIDNEY AND BRAIN DISORDER TREATMENT; ARTERIOSCLEROSIS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-02-12 | — | — | US | disclosed |