Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL245539 | 0.80 | ADORA1 (0.46) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL3359383 | 0.71 | KDM4E (0.60) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL16294362 | 0.69 | KDM4E (0.70) | KDM4EALDH1A1GAANPSR1RXFP1 | |
| SCHEMBL8473714 | 0.68 | KDM4E (0.50) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL23957342 | 0.67 | PTPN1 (0.50) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL28185544 | 0.67 | CYP11B1 (0.54) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL23629573 | 0.67 | PTPN1 (0.50) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL29152123 | 0.66 | PTPN1 (0.51) | ADORA1KDM4EALDH1A1GAAPTPN1 | |
| SCHEMBL12874583 | 0.66 | KDM4E (0.63) | ADORA1KDM4EALDH1A1GAANPSR1 | |
| SCHEMBL15712825 | 0.66 | PTPN1 (0.56) | ADORA1KDM4EALDH1A1GAAPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5006532-A | Enzyme inhibitor; antiinflammatory agents | MERCK & CO. INC., INC. (US) | 1991-04-09 | — | — | US | disclosed |