Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.70 |
| ▸ | CA2 | P00918 | 5/20 | 0.70 |
| ▸ | ACHE | P22303 | 5/20 | 0.70 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.67 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.67 |
| ▸ | NQO2 | P16083 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.45 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.45 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3975748 | 0.85 | MTNR1A (0.90) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL11852239 | 0.83 | CA1 (0.60) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL7337809 | 0.82 | CA1 (0.70) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL7210331 | 0.82 | CA1 (0.70) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL3854031 | 0.80 | MTNR1A (1.00) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL5783028 | 0.80 | CA1 (0.67) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL26763719 | 0.79 | MTNR1A (0.69) | CA1CA2MTNR1AMTNR1BTAOK1 | |
| Hydrochloric Acid SCHEMBL11488623 | 0.79 | CA1 (0.59) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL3395108 | 0.78 | CA1 (0.64) | CA1CA2ACHEMTNR1AMTNR1B | |
| SCHEMBL8624827 | 0.78 | CA1 (0.64) | CA1CA2ACHEMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0971878-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998038156-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-03 | — | — | WO | disclosed |