Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | PTGFR | P43088 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3338169 | 0.91 | POLB (0.50) | DYRK1APOLBCYP1A2NPC1CYP3A4 | |
| SCHEMBL3337363 | 0.76 | ADORA3 (0.40) | CYP1A2CYP3A4CYP2C19RAB9AADORA3 | |
| SCHEMBL3336353 | 0.75 | ACHE (0.47) | DYRK1AADORA3APPACHE | |
| SCHEMBL4526080 | 0.70 | GAK (0.48) | DYRK1AADORA3 | |
| SCHEMBL4528265 | 0.70 | ADORA3 (0.47) | POLBNPC1CYP2C19RAB9AADORA3 | |
| SCHEMBL3924803 | 0.70 | MAPK14 (0.39) | DYRK1APOLBADORA3 | |
| SCHEMBL4108181 | 0.70 | ADORA3 (0.41) | CYP1A2NPC1RAB9AADORA3APP | |
| SCHEMBL3920025 | 0.69 | ABL1 (0.42) | DYRK1APOLBADORA3 | |
| SCHEMBL3931835 | 0.69 | ADORA3 (0.41) | POLBNPC1RAB9AADORA3 | |
| SCHEMBL4066924 | 0.69 | DYRK1B (0.36) | DYRK1APOLBMAPTCDK5RXFP1 |
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-2010146173-A1 | QUINAZOLINE DERIVATIVES AS HISTAMINE H4-RECEPT0R INHIBITORS FOR USE IN THE TREATMENT OF INFLAMMATORY DISORDERS | VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) | 2010-12-23 | — | — | WO | disclosed |