Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.65 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.62 |
| ▸ | TMPRSS6 | Q8IU80 | 7/20 | 0.61 |
| ▸ | CA12 | O43570 | 2/20 | 0.60 |
| ▸ | CA9 | Q16790 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | F2 | P00734 | 4/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | PLAU | P00749 | 1/20 | 0.53 |
| ▸ | HPN | P05981 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5449745 | 0.86 | PRMT1 (0.68) | KEAP1PRMT1CA12CA9CYP1A2 | |
| SCHEMBL15555895 | 0.83 | TMPRSS6 (0.55) | KEAP1TMPRSS6CA12CA9CA1 | |
| SCHEMBL4168948 | 0.82 | KEAP1 (0.61) | KEAP1PRMT1CA12CA9CYP1A2 | |
| SCHEMBL7972526 | 0.82 | PRSS1 (0.58) | PRMT1TMPRSS6F2PLAULMNA | |
| SCHEMBL7972038 | 0.81 | PRSS1 (0.59) | PRMT1ALDH1A1F2PLAULMNA | |
| SCHEMBL7986040 | 0.81 | TMPRSS2 (0.59) | PRMT1TMPRSS6ALDH1A1F2PLAU | |
| SCHEMBL12348122 | 0.80 | TMPRSS6 (0.58) | TMPRSS6CA12CA9CYP3A4CA1 | |
| SCHEMBL28727051 | 0.80 | CYP19A1 (0.81) | KEAP1PRMT1CA12CA9CYP1A2 | |
| SCHEMBL407414 | 0.80 | KEAP1 (1.00) | KEAP1PRMT1CA12CA9CYP1A2 | |
| SCHEMBL7989750 | 0.80 | PRMT1 (0.60) | PRMT1ALDH1A1F2PLAULMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6114328-A | ANTICOAGULANTS; BLOOD DISORDERS | DUPONT PHARMACEUTICALS COMPANY (US) | 2000-09-05 | — | — | US | disclosed |
| US-5849736-A | Isoxazoline and isoxazole fibrinogen receptor antagonists | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-12-15 | — | — | US | disclosed |
| EP-0730590-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-09-11 | — | — | EP | disclosed |