Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2366129 | 0.79 | TAAR1 (0.47) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL18072397 | 0.78 | HRH4 (0.52) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL2366927 | 0.77 | TAAR1 (0.46) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL31737655 | 0.75 | HTR2C (0.53) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL16795346 | 0.75 | ADRB2 (0.42) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL1127150 | 0.74 | HTR2C (0.53) | ADRB1HTR2C | |
| SCHEMBL2366907 | 0.72 | HRH4 (0.48) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL22330233 | 0.72 | CHRNB2 (0.46) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL22322220 | 0.72 | CYP1A2 (0.44) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL5466686 | 0.72 | CHRNB2 (0.51) | MEN1CYP1A2CYP3A4CYP2D6TSHR |
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-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |