Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13565454 | 0.88 | LMNA (0.38) | TP53LMNAPOLBMAPTALDH1A1 | |
| SCHEMBL17090086 | 0.84 | POLB (0.44) | POLBMAPTALDH1A1 | |
| SCHEMBL13564861 | 0.84 | POLB (0.44) | POLBMAPTALDH1A1 | |
| SCHEMBL10114161 | 0.84 | NPY5R (0.43) | TP53LMNAPOLBFKBP1AALDH1A1 | |
| SCHEMBL13565579 | 0.83 | SCN8A (0.38) | — | |
| SCHEMBL13565419 | 0.81 | MEN1 (0.46) | TP53LMNAPOLBMAPTALDH1A1 | |
| SCHEMBL13565543 | 0.81 | KMT2A (0.46) | POLBALDH1A1 | |
| SCHEMBL11935165 | 0.78 | SMYD3 (0.50) | SMYD3CXCR4 | |
| SCHEMBL13564840 | 0.77 | CNR1 (0.38) | MAPT | |
| SCHEMBL13565548 | 0.77 | CNR2 (0.38) | — |
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-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |
| US-8299265-B2 | Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof | SHIONOGI & CO., LTD. (JP) | 2012-10-30 | — | — | US | disclosed |