Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 4/20 | 0.47 |
| ▸ | DRD2 | P14416 | 12/20 | 0.36 |
| ▸ | DRD3 | P35462 | 12/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8702145 | 0.99 | TACR1 (0.47) | TACR1DRD2DRD3CYP19A1L3MBTL1 | |
| SCHEMBL8701076 | 0.91 | TACR1 (0.38) | TACR1DRD2DRD3L3MBTL1 | |
| Hydrochloric Acid SCHEMBL8701615 | 0.90 | TACR1 (0.38) | TACR1DRD2DRD3L3MBTL1 | |
| SCHEMBL8701388 | 0.90 | TACR1 (0.58) | TACR1DRD2DRD3NR3C1 | |
| SCHEMBL8707768 | 0.89 | TACR1 (0.48) | TACR1DRD2DRD3CYP19A1 | |
| SCHEMBL8701948 | 0.88 | DRD2 (0.42) | TACR1DRD2DRD3L3MBTL1 | |
| Hydrochloric Acid SCHEMBL8707079 | 0.88 | DRD2 (0.41) | TACR1DRD2DRD3L3MBTL1 | |
| SCHEMBL8701944 | 0.87 | TACR1 (0.47) | TACR1DRD2DRD3 | |
| SCHEMBL8703805 | 0.84 | TACR1 (0.47) | TACR1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL8701137 | 0.83 | TACR1 (0.47) | TACR1DRD2DRD3 |
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-5721255-A | Substituted benzylamino nitrogen containing non-aromatic heterocycles | PFIZER INC. (US) | 1998-02-24 | — | — | US | claimed |
| US-5721255-A | Substituted benzylamino nitrogen containing non-aromatic heterocycles | PFIZER INC. (US) | 1998-02-24 | — | — | US | disclosed |