Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.53 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.38 |
| ▸ | USP2 | O75604 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154561 | 0.86 | CHRNB2 (0.54) | CHRNB2CHRNA4RETKCNJ1KCNH2 | |
| SCHEMBL20148753 | 0.83 | CHRNB2 (0.51) | CHRNB2CHRNA4RETKCNJ1KCNH2 | |
| SCHEMBL5572058 | 0.80 | CHRNB2 (0.47) | CHRNB2CHRNA4RETKCNJ1KCNH2 | |
| SCHEMBL5389142 | 0.74 | CHRNB2 (0.57) | CHRNB2CHRNA4KCNJ1KCNH2CHRNB4 | |
| SCHEMBL5312452 | 0.74 | CHRNB2 (0.72) | CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL31637440 | 0.71 | CHRNB2 (0.53) | CHRNB2CHRNA4RETKCNJ1KCNH2 | |
| SCHEMBL30057551 | 0.71 | CHRNB2 (0.56) | CHRNB2CHRNA4KCNJ1KCNH2CHRNB4 | |
| SCHEMBL20798113 | 0.71 | CHRNB2 (0.56) | CHRNB2CHRNA4KCNJ1KCNH2CHRNB4 | |
| SCHEMBL5645839 | 0.70 | CHRNB2 (0.58) | CHRNB2CHRNA4KCNJ1KCNH2CHRNB4 | |
| SCHEMBL5230743 | 0.70 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNB4CHRNA3 |
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-2018071447-A1 | SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS | ANDREWS STEVEN W (US) | 2018-04-19 | — | — | WO | disclosed |