Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7462332 | 0.90 | KMT2A (0.51) | KMT2APDE4BMEN1ALDH1A1PDE3A | |
| SCHEMBL2840516 | 0.81 | ALDH1A1 (0.64) | PDE4BALDH1A1PDE3A | |
| SCHEMBL7560477 | 0.81 | ALDH1A1 (0.64) | PDE4BALDH1A1PDE3A | |
| SCHEMBL29808190 | 0.81 | ALDH1A1 (0.64) | PDE4BALDH1A1PDE3A | |
| SCHEMBL70835 | 0.81 | ALDH1A1 (0.64) | PDE4BALDH1A1PDE3A | |
| SCHEMBL16619850 | 0.81 | ALDH1A1 (0.59) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL96635 | 0.81 | ALDH1A1 (0.59) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL4637156 | 0.80 | ALDH1A1 (0.62) | PDE4BALDH1A1PDE3A | |
| SCHEMBL2847455 | 0.80 | ALDH1A1 (0.62) | PDE4BALDH1A1PDE3A | |
| SCHEMBL6883557 | 0.79 | ALDH1A1 (0.66) | PDE4BALDH1A1PDE3A |
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-6197800-B1 | HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS | MERCK PATENT GESELLSCHAFT MI BESCHRAENKTER HAFTUNG (DE) | 2001-03-06 | — | — | US | disclosed |
| CN-1265102-A | Benzothia (oxa) diazol derivatives and their use as endothelin-receptor antagonists | MERCK PATENT GMBH (DE) | 2000-08-30 | — | — | CN | disclosed |
| EP-1000044-A1 | BENZOTHIA(OXA)DIAZOL DERIVATIVES AND THEIR USE AS ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999005132-A1 | BENZOTHIA(OXA)DIAZOL DERIVATIVES AND THEIR USE AS ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 1999-02-04 | — | — | WO | disclosed |