Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | TACR3 | P29371 | 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 | |
|---|---|---|---|---|
| SCHEMBL26645905 | 1.00 | NPSR1 (0.45) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL4873651 | 0.89 | NPSR1 (0.45) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL3359407 | 0.89 | NPSR1 (0.45) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL1576937 | 0.89 | NPSR1 (0.45) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL16656041 | 0.87 | GRM2 (0.43) | NPSR1MEN1KMT2ADRD4BCHE | |
| SCHEMBL4484399 | 0.85 | NPSR1 (0.46) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL4484395 | 0.85 | NPSR1 (0.46) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL3580943 | 0.83 | NPSR1 (0.44) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL3580952 | 0.83 | NPSR1 (0.44) | NPSR1MEN1KMT2ADRD4ALDH1A1 | |
| SCHEMBL3580947 | 0.83 | NPSR1 (0.44) | NPSR1MEN1KMT2ADRD4ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011101161-A1 | PYRAZOLE DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2011-08-25 | — | — | WO | disclosed |