Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATF4 | P18848 | 1/20 | 0.37 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3665644 | 0.93 | CHRM4 (0.43) | EPHX2HRH3MCHR1HTR1ADRD2 | |
| SCHEMBL3663685 | 0.87 | HRH3 (0.52) | EPHX2HRH3SCN9ASCN1ASCN5A | |
| SCHEMBL3668600 | 0.86 | DRD4 (0.52) | MCHR1KCNH2SLC6A5DRD4FFAR1 | |
| SCHEMBL649755 | 0.86 | SLC6A5 (0.54) | SLC6A4MCHR1KCNH2SLC6A5DRD4 | |
| SCHEMBL4431231 | 0.84 | SCN9A (0.46) | EPHX2HRH3SCN9ASCN1ASCN5A | |
| SCHEMBL648264 | 0.84 | SLC6A4 (0.45) | SLC6A4SCN9AMCHR1SLC6A5HTR1A | |
| SCHEMBL4427569 | 0.84 | HRH3 (0.51) | EPHX2HRH3SCN9ASCN1ASCN5A | |
| SCHEMBL3659838 | 0.83 | SLC6A4 (0.43) | SLC6A4EPHX2SCN9AMCHR1KCNH2 | |
| SCHEMBL648322 | 0.83 | DRD4 (0.52) | SLC6A4MCHR1KCNH2SLC6A5DRD4 | |
| Hydrochloric Acid SCHEMBL647344 | 0.83 | SLC6A4 (0.44) | SLC6A4SCN9AMCHR1SLC6A5HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2231600-A1 | CARBOXAMIDE, SULFONAMIDE AND AMINE COMPOUNDS FOR METABOLIC DISORDERS | Rigel Pharmaceuticals, Inc. (US) | 2010-09-29 | — | — | EP | claimed |
| WO-2009065131-A1 | CARBOXAMIDE, SULFONAMIDE AND AMINE COMPOUNDS FOR METABOLIC DISORDERS | RIGEL PHARMACEUTICALS, INC. (US) | 2009-05-22 | — | — | WO | claimed |