Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.73 |
| ▸ | CA2 | P00918 | 2/20 | 0.73 |
| ▸ | ACHE | P22303 | 2/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | TLR4 | O00206 | 1/20 | 0.58 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.57 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.56 |
| ▸ | CTSB | P07858 | 1/20 | 0.56 |
| ▸ | CTSK | P43235 | 1/20 | 0.56 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.54 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.53 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL170233 | 0.90 | ALDH1A1 (0.65) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL5677446 | 0.89 | CA1 (0.63) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL7591612 | 0.89 | CA1 (0.63) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL30061424 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL30968514 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL23938186 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL28576386 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL17549529 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL21855472 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA | |
| SCHEMBL30059982 | 0.87 | CA1 (0.61) | CA1CA2ACHEALDH1A1GAA |
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-5272157-A | Derivatives of 4-(aminomethyl) piperidine, their preparation and their therapeutic application | SYNTHELABO (FR) | 1993-12-21 | — | — | US | disclosed |
| US-5179108-A | Antiserotonin agents or cardiovascular disorders | SYNTHELABO (FR) | 1993-01-12 | — | — | US | disclosed |