Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL9748432 | 0.96 | CYP3A4 (0.49) | CYP3A4SMPD1BCHERAB9ACACNA1S | |
| Oxalic Acid SCHEMBL7294755 | 0.90 | CYP3A4 (0.49) | CYP3A4CACNA1SABCB1 | |
| Oxalic Acid SCHEMBL9747733 | 0.90 | CYP3A4 (0.49) | CYP3A4CACNA1SABCB1 | |
| Hydrochloric Acid SCHEMBL9749787 | 0.90 | CYP3A4 (0.46) | CYP3A4SMPD1BCHERAB9ACACNA1S | |
| Hydrochloric Acid SCHEMBL9748803 | 0.90 | CYP3A4 (0.46) | CYP3A4SMPD1BCHERAB9ACACNA1S | |
| Oxalic Acid SCHEMBL9748543 | 0.90 | CYP3A4 (0.47) | CYP3A4CACNA1SABCB1 | |
| SCHEMBL7376974 | 0.89 | CYP3A4 (0.65) | CYP3A4BCHECACNA1SACHE | |
| Fumaric Acid SCHEMBL9747504 | 0.88 | CYP3A4 (0.45) | CYP3A4ABCB1 | |
| Fumaric Acid SCHEMBL9747497 | 0.88 | CYP3A4 (0.45) | CYP3A4ABCB1 | |
| Hydrochloric Acid SCHEMBL9748141 | 0.88 | CYP3A4 (0.48) | CYP3A4SMPD1RAB9ACACNA1SABCB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0237573-B1 | NOVEL BENZOTHIAZINE DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1992-01-15 | — | — | EP | claimed |
| US-4786635-A | THERAPEUTIC AGENTS FOR CIRCULATORY DISEASES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1988-11-22 | — | — | US | claimed |
| EP-0237573-A1 | NOVEL BENZOTHIAZINE DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1987-09-23 | — | — | EP | claimed |