Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.64 |
| ▸ | CA2 | P00918 | 4/20 | 0.64 |
| ▸ | ACHE | P22303 | 4/20 | 0.64 |
| ▸ | DRD2 | P14416 | 8/20 | 0.59 |
| ▸ | DRD3 | P35462 | 8/20 | 0.59 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.59 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.59 |
| ▸ | DRD4 | P21917 | 3/20 | 0.54 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 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 | |
|---|---|---|---|---|
| SCHEMBL8237115 | 1.00 | CA1 (0.64) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL8624827 | 1.00 | CA1 (0.64) | CA1CA2ACHEDRD2DRD3 | |
| Hydrochloric Acid SCHEMBL10851134 | 0.98 | CA1 (0.63) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL8056611 | 0.94 | DRD2 (0.68) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL8056606 | 0.94 | DRD2 (0.68) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL8056603 | 0.94 | DRD2 (0.68) | CA1CA2ACHEDRD2DRD3 | |
| Hydrochloric Acid SCHEMBL10853587 | 0.92 | DRD2 (0.66) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL11974942 | 0.86 | DRD2 (0.54) | CA1CA2ACHEDRD2DRD3 | |
| Hydrochloric Acid SCHEMBL1026189 | 0.85 | DRD2 (0.52) | CA1CA2ACHEDRD2DRD3 | |
| SCHEMBL11493562 | 0.83 | DRD2 (0.71) | CA1CA2ACHEDRD2DRD3 |
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-0817767-A1 | BICYCLIC AMINE DERIVATIVES AND THEIR USE AS ANTI-PSYCHOTIC AGENTS | SMITHKLINE BEECHAM PLC (GB) | 1998-01-14 | — | — | EP | disclosed |
| WO-1996030333-A1 | BICYCLIC AMINE DERIVATIVES AND THEIR USE AS ANTI-PSYCHOTIC AGENTS | SMITHKLINE BEECHAM PLC (GB) | 1996-10-03 | — | — | WO | disclosed |