Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 3/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9205771 | 1.00 | DRD3 (0.50) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| SCHEMBL9205808 | 1.00 | DRD3 (0.50) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| SCHEMBL9205750 | 0.93 | DRD3 (0.57) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| SCHEMBL9206686 | 0.93 | DRD3 (0.57) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| SCHEMBL9205435 | 0.93 | DRD3 (0.57) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| Hydrochloric Acid SCHEMBL7831882 | 0.92 | DRD3 (0.56) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| Hydrochloric Acid SCHEMBL7816927 | 0.92 | DRD3 (0.56) | DRD3DRD2DRD4CYP3A4CHRNB4 | |
| SCHEMBL1117818 | 0.80 | CA2 (0.62) | DRD3DRD2DRD4SMN1; SMN2HTR1A | |
| SCHEMBL9116625 | 0.80 | CA2 (0.55) | DRD3HTR1AADRA2ADRD1TBXA2R | |
| SCHEMBL13646391 | 0.80 | CA2 (0.42) | DRD3HTR1AADRA2ADRD1TBXA2R |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0520674-B1 | Antipsychotic benzodioxan derivatives | AMERICAN HOME PROD (US) | 1995-08-16 | — | — | EP | disclosed |
| US-5189171-A | Antipsychotic benzodioxan derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1993-02-23 | — | — | US | disclosed |
| EP-0520674-A1 | Antipsychotic benzodioxan derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-12-30 | — | — | EP | disclosed |
| US-5166367-A | Anxiolytic agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-11-24 | — | — | US | disclosed |