Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.59 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | EGLN1 | Q9GZT9 | 8/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL2638074 | 0.81 | PTGS1 (0.59) | PTGS1PTGS2APPEGLN1RAB9A | |
| SCHEMBL9753842 | 0.81 | PTGS1 (0.59) | PTGS1PTGS2EGLN1RAB9ANPC1 | |
| SCHEMBL870792 | 0.81 | PTGS1 (0.59) | PTGS1PTGS2APPCLK1DYRK1A | |
| SCHEMBL2485534 | 0.80 | PTGS1 (0.57) | PTGS1PTGS2APPEGLN1RAB9A | |
| SCHEMBL299158 | 0.80 | HRH4 (0.58) | PTGS1PTGS2APPCLK1DYRK1A | |
| Hydrochloric Acid SCHEMBL1422913 | 0.80 | PTGS1 (0.57) | PTGS1PTGS2APPCLK1DYRK1A | |
| SCHEMBL1500394 | 0.80 | PTGS1 (0.57) | PTGS1PTGS2APPCLK1DYRK1A | |
| SCHEMBL1734073 | 0.80 | PTGS1 (0.62) | PTGS1PTGS2APPEGLN1RAB9A | |
| SCHEMBL22288989 | 0.79 | MCHR1 (0.49) | PTGS1PTGS2EGLN1RAB9ANPC1 | |
| SCHEMBL741720 | 0.79 | HRH4 (0.57) | PTGS1PTGS2APPCLK1DYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112689636-A | Novel heteroatom aromatic amide derivative and drug containing the same | 科研制药株式会社 | 2021-04-20 | — | — | CN | disclosed |