Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 5/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL18291282 | 0.80 | CHRNB2 (0.41) | NPC1RAB9ASCN9AHTR2CCHRNB2 | |
| SCHEMBL20249280 | 0.74 | NPC1 (0.38) | PDK2NPC1RAB9ASCN9AKDM4E | |
| SCHEMBL28830636 | 0.71 | HRH2 (0.38) | NPC1RAB9AHTR2CPOLBMEN1 | |
| SCHEMBL1596034 | 0.69 | ALDH1A1 (0.36) | SCN9AKDM4EMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL20745829 | 0.68 | ALDH1A1 (0.36) | SCN9AKDM4EMEN1KMT2A | |
| SCHEMBL5337457 | 0.67 | JAK2 (0.34) | POLB | |
| SCHEMBL20528090 | 0.65 | MGLL (0.33) | MEN1KMT2A | |
| SCHEMBL15432724 | 0.65 | MGLL (0.33) | MEN1KMT2A | |
| SCHEMBL20660200 | 0.64 | DUT (0.39) | — | |
| SCHEMBL1583740 | 0.64 | MEN1 (0.35) | NPC1RAB9AHTR2CPOLBKDM4E |
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-3305785-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2018-04-11 | — | — | EP | disclosed |