Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 8/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19594483 | 0.77 | CHRNB2 (0.47) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 | |
| SCHEMBL4071841 | 0.69 | — | — | |
| SCHEMBL11933858 | 0.68 | CHRNB2 (0.47) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 | |
| SCHEMBL23008458 | 0.67 | CHRNB2 (0.50) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 | |
| SCHEMBL18083545 | 0.64 | — | — | |
| SCHEMBL12533764 | 0.64 | CYP11B2 (0.67) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 | |
| SCHEMBL990213 | 0.64 | — | — | |
| SCHEMBL29848157 | 0.64 | — | — | |
| SCHEMBL12533763 | 0.64 | CYP11B2 (0.67) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 | |
| SCHEMBL12533759 | 0.64 | CYP11B2 (0.67) | CYP11B2CHRNB2CHRNA4CHRNA7CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2318408-B1 | TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS | VERTEX PHARMA (US) | 2016-02-17 | — | — | EP | disclosed |