Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | RECQL | P46063 | 2/20 | 0.55 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CTRB1 | P17538 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPRA | P18433 | 1/20 | 0.41 |
| ▸ | PTPRB | P23467 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7959025 | 0.81 | MEN1 (0.57) | ALDH1A1SMN1; SMN2PTPN2PTPN1PTPRB | |
| SCHEMBL6514301 | 0.77 | ALDH1A1 (0.65) | ALDH1A1RECQLMMP8MAPTCYP3A4 | |
| SCHEMBL28168069 | 0.75 | ALDH1A1 (0.67) | ALDH1A1RECQLMMP8MAPTCYP3A4 | |
| SCHEMBL25846939 | 0.75 | ALDH1A1 (0.54) | ALDH1A1RECQLMMP8MAPTCYP3A4 | |
| SCHEMBL27457092 | 0.74 | ALDH1A1 (0.47) | ALDH1A1RECQLMMP8CYP3A4CYP2C9 | |
| SCHEMBL6497301 | 0.74 | TSHR (0.43) | ALDH1A1RECQLMMP8CYP3A4CYP2C9 | |
| SCHEMBL8410894 | 0.74 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8MAPTCYP3A4 | |
| SCHEMBL8583261 | 0.74 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8CYP3A4CYP2C9 | |
| SCHEMBL2331138 | 0.74 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8MAPTCYP3A4 | |
| SCHEMBL2329888 | 0.74 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8MAPTCYP3A4 |
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-1996574-A1 | QUINOLINE AND ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS | Amgen Inc. (US) | 2008-12-03 | — | — | EP | disclosed |
| WO-2007103554-A1 | QUINOLINE AND ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS | AMGEN INC. (US) | 2007-09-13 | — | — | WO | disclosed |