Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 SCHEMBL8702143 | 0.99 | TACR1 (0.35) | TACR1KMT2AMEN1CYP19A1PTGS2 | |
| SCHEMBL8701074 | 0.91 | KMT2A (0.34) | KMT2AMEN1ALDH1A1PKM | |
| Hydrochloric Acid SCHEMBL8701612 | 0.90 | KMT2A (0.33) | KMT2AMEN1ALDH1A1PKM | |
| SCHEMBL8701385 | 0.90 | TACR1 (0.45) | TACR1KMT2AMEN1PTGS2ALDH1A1 | |
| SCHEMBL8706539 | 0.90 | KMT2A (0.32) | KMT2AMEN1ALDH1A1PKM | |
| Hydrochloric Acid SCHEMBL8701563 | 0.89 | KMT2A (0.32) | KMT2AMEN1ALDH1A1PKM | |
| SCHEMBL8701943 | 0.88 | NPSR1 (0.39) | KMT2AMEN1ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL8707078 | 0.87 | NPSR1 (0.38) | KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL8701939 | 0.86 | TACR1 (0.35) | TACR1CYP19A1PTGS2BRD4 | |
| Hydrochloric Acid SCHEMBL8707886 | 0.86 | TACR1 (0.35) | TACR1CYP19A1PTGS2BRD4 |
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 |