Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | SMPD3 | Q9NY59 | 4/20 | 0.32 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL20119515 | 0.88 | MAPT (0.48) | MAPTALDH1A1POLBCYP2C9CYP2C19 | |
| SCHEMBL21319518 | 0.84 | SIGMAR1 (0.36) | MAPTALDH1A1SMN1; SMN2IKBKBIRAK4 | |
| SCHEMBL21313045 | 0.79 | NTRK1 (0.43) | POLBSMN1; SMN2PTPN2PTPN1 | |
| SCHEMBL21313079 | 0.79 | NTRK1 (0.43) | POLBSMN1; SMN2PTPN2PTPN1 | |
| SCHEMBL20119571 | 0.79 | NTRK1 (0.43) | POLBSMN1; SMN2PTPN2PTPN1 | |
| SCHEMBL23865295 | 0.74 | SMPD3 (0.51) | ALDH1A1IRAK4SMPD3 | |
| SCHEMBL20119122 | 0.74 | SMPD3 (0.51) | ALDH1A1IRAK4SMPD3 | |
| SCHEMBL20119481 | 0.73 | SMPD3 (0.43) | MAPTALDH1A1SMN1; SMN2IRAK4SMPD3 | |
| SCHEMBL21319640 | 0.72 | SMPD3 (0.59) | ALDH1A1SMN1; SMN2IRAK4SMPD3 | |
| SCHEMBL21313087 | 0.68 | NTRK1 (0.41) | POLBSMN1; SMN2PTPN2PTPN1 |
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-2018077246-A1 | AMINO PYRAZOLOPYRIMIDINE COMPOUND USED AS NEUROTROPHIC FACTOR TYROSINE KINASE RECEPTOR INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-05-03 | — | — | WO | disclosed |