Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 4/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL20089414 | 0.82 | CHRNB2 (0.41) | CHRNB2CHRNA4KMT2ACHRNB1CHRNB4 | |
| SCHEMBL13020439 | 0.82 | CHRNB2 (0.45) | NUDT1CHRNB2CHRNA4KMT2ACHRNB1 | |
| SCHEMBL20037619 | 0.81 | NUDT1 (0.48) | NUDT1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL20231023 | 0.81 | CHRNB2 (0.38) | CHRNB2CHRNA4KMT2ACHRNB1CHRNB4 | |
| SCHEMBL20037812 | 0.81 | NUDT1 (0.41) | NUDT1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL20249195 | 0.81 | NUDT1 (0.41) | NUDT1CHRNB2CHRNA4PRKAB2PRKAG1 | |
| SCHEMBL18291562 | 0.79 | CACNA1I (0.42) | NUDT1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL20037956 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA4KMT2ACHRNB1CHRNB4 | |
| SCHEMBL7925898 | 0.77 | CHRNB2 (0.45) | CHRNB2CHRNA4KMT2ACHRNB1CHRNB4 | |
| SCHEMBL506299 | 0.77 | CHRNB2 (0.42) | CHRNB2CHRNA4KMT2ACHRNB1CHRNB4 |
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 |