Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | CA7 | P43166 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11115382 | 0.79 | ALDH1A1 (0.47) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11106663 | 0.77 | ESR1 (0.48) | BACE1TAAR1ACHE | |
| SCHEMBL11105988 | 0.72 | KDM4E (0.42) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11110192 | 0.71 | ALDH1A1 (0.42) | TAAR1 | |
| SCHEMBL11114038 | 0.67 | CA12 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11107666 | 0.67 | ALDH1A1 (0.47) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11111919 | 0.65 | ACHE (0.39) | BACE1TAAR1ACHE | |
| SCHEMBL11112436 | 0.63 | MAOB (0.59) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11107774 | 0.63 | NR1I2 (0.57) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11103053 | 0.62 | CA2 (0.38) | CA12CA1CA2CA7CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4454158-A | Allyl amine MAO inhibitors | MERRELL TORAUDE ET COMPAGNIE (FR) | 1984-06-12 | — | — | US | disclosed |