Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.50 |
| ▸ | HRH1 | P35367 | 2/20 | 0.48 |
| ▸ | ABAT | P80404 | 1/20 | 0.48 |
| ▸ | AKT2 | P31751 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3678682 | 0.91 | MAOA (0.62) | MAOAHTR2ALOXL2HRH1AKT2 | |
| SCHEMBL21580517 | 0.90 | MAOA (0.62) | MAOAHRH3HTR2ALOXL2HRH1 | |
| SCHEMBL31524115 | 0.88 | HRH3 (0.58) | MAOAHRH3HTR2ALOXL2HRH1 | |
| Hydrochloric Acid SCHEMBL6561599 | 0.88 | MAOA (0.59) | MAOAHTR2AHRH1AKT2CYP2A6 | |
| SCHEMBL6312084 | 0.88 | HRH3 (0.58) | MAOAHRH3HTR2ALOXL2ABAT | |
| SCHEMBL6563337 | 0.86 | HTR2A (0.68) | MAOAHTR2ALOXL2HRH1CYP2A6 | |
| Hydrochloric Acid SCHEMBL6563435 | 0.83 | HTR2A (0.65) | MAOAHTR2ALOXL2CYP2A6TAAR1 | |
| SCHEMBL15245000 | 0.83 | AKT2 (0.62) | MAOAHRH3HTR2AHRH1AKT2 | |
| SCHEMBL2642760 | 0.82 | LOXL2 (0.63) | HRH3HTR2ALOXL2ABATCYP2A6 | |
| SCHEMBL3680378 | 0.82 | MAOA (0.75) | MAOAHTR2AHRH1CYP2A6TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101090883-A | Substituted hydroxyethylamines | ELAN PHARM INC (US) | 2007-12-19 | — | — | CN | disclosed |
| US-6890930-B1 | Quinazolinones | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2005-05-10 | — | — | US | disclosed |