Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.39 |
| ▸ | MAOB | P27338 | 6/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL14123664 | 1.00 | MAOA (0.39) | MAOAMAOBCES1ESR1CA2 | |
| SCHEMBL5008736 | 1.00 | MAOA (0.39) | MAOAMAOBCES1ESR1CA2 | |
| SCHEMBL7792771 | 0.98 | MAOA (0.40) | MAOAMAOBCES1ESR1CA2 | |
| SCHEMBL7791505 | 0.93 | MAOA (0.41) | MAOAMAOBCES1ESR1POLB | |
| SCHEMBL7790765 | 0.79 | MAOA (0.37) | MAOAMAOBCES1ESR1POLB | |
| SCHEMBL7792764 | 0.77 | ESR1 (0.47) | MAOAMAOBCES1ESR1CYP3A4 | |
| SCHEMBL8396822 | 0.76 | MAOA (0.42) | MAOAMAOBCES1ESR1POLB | |
| SCHEMBL7783038 | 0.75 | MAOA (0.39) | MAOAMAOBCES1ESR1NPSR1 | |
| SCHEMBL8624256 | 0.74 | MAOA (0.33) | MAOAMAOB | |
| SCHEMBL20690145 | 0.74 | MAOA (0.42) | MAOAMAOBCES1CA2POLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080194887-A1 | SEPARATION OF FLUOROUS COMPOUNDS | PITTSBURGH UNIVERSITY OF - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION | 2008-08-14 | — | — | US | disclosed |
| US-7364908-B2 | Separation of fluorous compounds | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2008-04-29 | — | — | US | disclosed |
| EP-1765783-A1 | SEPARATION OF FLUOROUS COMPOUNDS | UNIVERSITY OF PITTSBURGH (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2006009835-A1 | SEPARATION OF FLUOROUS COMPOUNDS | UNIVERSITY OF PITTSBURGH (US) | 2006-01-26 | — | — | WO | disclosed |
| US-20050283032-A1 | charging a mixture of compounds to a non-fluorous solid phase (silica gel, alumina, zirconia) and eluting with a fluorous eluting fluid (hydrofluoroalkane, a hydrofluoroether, a hydrofluoroamine, a perfluoroalkane, a perfluoroether, or a perfluoroamine) and a cosolvent: difference in fluorous nature | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2005-12-22 | — | — | US | disclosed |