Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL11935601 | 0.91 | ALDH1A1 (0.48) | CA9CA12CA1CA2POLB | |
| SCHEMBL13565702 | 0.89 | ESR1 (0.40) | CA9CA12CA1CA2POLB | |
| SCHEMBL11935602 | 0.88 | ALDH1A1 (0.39) | CA9CA12CA1CA2POLB | |
| SCHEMBL13565967 | 0.87 | ALDH1A1 (0.38) | CA9CA12CA1CA2POLB | |
| SCHEMBL13565660 | 0.87 | CA9 (0.39) | CA9CA12CA1CA2POLB | |
| SCHEMBL10115349 | 0.87 | ALDH1A1 (0.43) | CA9CA12CA1CA2POLB | |
| SCHEMBL11935719 | 0.83 | ALDH1A1 (0.40) | CA9CA12CA1CA2POLB | |
| SCHEMBL13564882 | 0.82 | CNR2 (0.44) | POLBALDH1A1HPGDMAPTCNR2 | |
| SCHEMBL11935312 | 0.81 | MAPT (0.43) | CA1CA2POLBMAPTCNR2 | |
| SCHEMBL17090252 | 0.81 | CA1 (0.41) | CA9CA12CA1CA2POLB |
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 |