Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 12/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 12/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL2434546 | 0.83 | EPHX1 (0.33) | GAATHRBALDH1A1KDM4ELMNA | |
| SCHEMBL29640874 | 0.80 | ESR2 (0.38) | GAATHRBKDM4ELMNA | |
| SCHEMBL9785383 | 0.80 | AKR1C3 (0.40) | AKR1C3AKR1C2AKR1C1PTGS1P4HTM | |
| SCHEMBL9785388 | 0.80 | AKR1C3 (0.40) | AKR1C3AKR1C2AKR1C1PTGS1P4HTM | |
| SCHEMBL5296036 | 0.80 | GPR84 (0.43) | LMNA | |
| SCHEMBL5296026 | 0.80 | GPR84 (0.43) | LMNA | |
| SCHEMBL350463 | 0.75 | AKR1C3 (0.61) | AKR1C3AKR1C2AKR1C1PTGS1P4HTM | |
| SCHEMBL1574429 | 0.74 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1PTGS1GAA | |
| SCHEMBL510548 | 0.72 | ALDH1A1 (0.56) | AKR1C3AKR1C2AKR1C1PTGS1GAA | |
| SCHEMBL564831 | 0.72 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112218857-B | P300/CBP HAT inhibitors and methods of use thereof | 星座制药公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-114450005-A | Compounds for the treatment of neurological disorders | 星座制药公司 | 2022-05-06 | — | — | CN | disclosed |