Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | MEN1 | O00255 | 8/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7668325 | 0.80 | ENPP2 (0.53) | ADORA3ADORA2AADORA2BADORA1MEN1 | |
| SCHEMBL7662908 | 0.80 | ENPP2 (0.53) | ADORA3ADORA2AADORA2BADORA1MEN1 | |
| SCHEMBL7680266 | 0.79 | ADORA3 (0.75) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL8019113 | 0.79 | RAD51 (0.40) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL14372490 | 0.79 | KCNK3 (0.69) | MEN1KMT2ACA1CA2CA9 | |
| SCHEMBL6245393 | 0.78 | TIMP3 (0.58) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL4661858 | 0.76 | CA1 (0.78) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL8023216 | 0.75 | ADORA3 (0.54) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL28248552 | 0.73 | CA1 (0.53) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL12630749 | 0.73 | ALDH1A1 (0.52) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 |
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-2000058277-A1 | ARYL SULFONIC ACIDS AND DERIVATIVES AS FSH ANTAGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-10-05 | — | — | WO | disclosed |