Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.57 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.51 |
| ▸ | GHSR | Q92847 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29661999 | 1.00 | TACR1 (0.57) | TACR1NPY5RGHSR | |
| SCHEMBL29661957 | 0.89 | RORC (0.46) | TACR1 | |
| SCHEMBL2878354 | 0.88 | TACR1 (0.68) | TACR1NPY5RGHSR | |
| SCHEMBL2625791 | 0.87 | HDAC1 (0.50) | TACR1 | |
| SCHEMBL4974614 | 0.87 | HDAC1 (0.50) | TACR1 | |
| SCHEMBL29662002 | 0.86 | TACR1 (0.50) | TACR1NPY5RGHSR | |
| SCHEMBL2632889 | 0.85 | HDAC1 (0.54) | TACR1 | |
| SCHEMBL26969702 | 0.84 | GNRHR (0.47) | TACR1 | |
| SCHEMBL13180673 | 0.81 | HDAC1 (0.45) | TACR1 | |
| SCHEMBL20955202 | 0.81 | XIAP (0.46) | TACR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6013652-A | ANTIINFLAMMATORY AGENTS; ANALGESICS; ANTIHISTAMINES | MERCK & CO., INC. (US) | 2000-01-11 | — | — | US | disclosed |
| US-5962462-A | COMPOUNDS WHICH INHIBIT THE ENTRY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) INTO TARGET CELLS; DELAYING THE ONSET OF ACQUIRED IMMUNE DEFICIENCY SYNDROME (AIDS). | MERCK & CO., INC. (US) | 1999-10-05 | — | — | US | disclosed |