Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 2/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3632334 | 0.86 | MAPT (0.40) | HSD17B10GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3629772 | 0.82 | TSHR (0.46) | GAANLRP3SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL3633768 | 0.78 | MEN1 (0.47) | HSD17B10GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2336414 | 0.76 | SRC (0.54) | GAASMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL1549076 | 0.76 | CSNK2A1 (0.53) | CYP1A2SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL11276801 | 0.75 | EGFR (0.54) | ALDH1A1MEN1KMT2AMAPTPKM | |
| SCHEMBL31502446 | 0.74 | MAPT (0.44) | HSD17B10SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL28942768 | 0.74 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL15334365 | 0.73 | GAA (0.52) | HSD17B10GAASMN1; SMN2MEN1KMT2A | |
| SCHEMBL11864026 | 0.73 | PPARG (0.57) | HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1 |
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-2150534-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008131779-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2008-11-06 | — | — | WO | disclosed |