Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21962937 | 0.85 | KMT2A (0.51) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL7332201 | 0.84 | CYP1A2 (0.61) | CYP1A2 | |
| SCHEMBL7332196 | 0.84 | CYP1A2 (0.61) | CYP1A2 | |
| SCHEMBL7326144 | 0.84 | CYP1A2 (0.61) | CYP1A2 | |
| SCHEMBL7335528 | 0.84 | KMT2A (0.50) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL7332197 | 0.84 | KMT2A (0.50) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL21962922 | 0.84 | KMT2A (0.57) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL7335530 | 0.82 | MEN1 (0.49) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL25829681 | 0.82 | KMT2A (0.49) | KMT2AMEN1CA12CA2CA9 | |
| SCHEMBL7269972 | 0.81 | POLB (0.48) | KMT2AMEN1CA12CA2CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5039664-A | Hypotensive agent | MERCK & CO., INC. (US) | 1991-08-13 | — | — | US | disclosed |
| US-5037807-A | Hypotensive agents; for treatment of congestive heart failure | MERCK & CO., INC. (US) | 1991-08-06 | — | — | US | disclosed |
| US-4839357-A | TREATMENT OF HYPERTENSION, CONGESTIVE HEART FAILURE | MERCK & CO., INC. (US) | 1989-06-13 | — | — | US | disclosed |
| EP-0278158-A2 | Renin inhibitors containing phenylalanyl-histidine replacements | MERCK & CO. INC. (US) | 1988-08-17 | — | — | EP | disclosed |