Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21177528 | 0.88 | ADORA3 (0.42) | CYP1A2ADORA2AADORA3MAPTPOLB | |
| SCHEMBL21177355 | 0.87 | ADORA3 (0.42) | CYP1A2ADORA2AADORA3MAPTPOLB | |
| SCHEMBL20064665 | 0.86 | CYP1A2 (0.44) | CYP1A2ADORA2AADORA3MAPTPOLB | |
| SCHEMBL20723167 | 0.82 | CYP1A2 (0.45) | CYP1A2ADORA2AMAPTKDM4EALDH1A1 | |
| SCHEMBL25465499 | 0.81 | MAPT (0.38) | MAPTPOLBKDM4EALDH1A1HPGD | |
| SCHEMBL21189850 | 0.79 | KDM4E (0.45) | CYP1A2MAPTPOLBKDM4EALDH1A1 | |
| SCHEMBL20568880 | 0.78 | GSK3B (0.45) | CYP1A2ADORA2AMAPTPOLBKDM4E | |
| SCHEMBL9679448 | 0.78 | ALDH1A1 (0.48) | CYP1A2ADORA2AADORA3POLBKDM4E | |
| SCHEMBL21177423 | 0.77 | KDM4E (0.45) | CYP1A2ADORA2AMAPTPOLBKDM4E | |
| SCHEMBL20568271 | 0.76 | GSK3B (0.44) | CYP1A2ADORA2AMAPTPOLBKDM4E |
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-2019141694-A1 | PI4KIIIBETA INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-07-25 | — | — | WO | disclosed |