Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HINT1 | P49773 | 2/20 | 0.40 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.39 |
| ▸ | AHCY | P23526 | 1/20 | 0.38 |
| ▸ | NT5E | P21589 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.34 |
| ▸ | CDK2 | P24941 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | PNP | P00491 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL9548875 | 0.88 | ADORA2A (0.44) | HSP90B1AHCYADORA2AADORA3TP53 | |
| SCHEMBL9548702 | 0.85 | HINT1 (0.43) | HINT1ADORA3PNP | |
| SCHEMBL9548624 | 0.85 | AHCY (0.45) | HSP90B1AHCYCDK1CCNB1CCNE1 | |
| SCHEMBL9548612 | 0.82 | HINT1 (0.42) | HINT1HSP90B1AHCYNT5EADORA2A | |
| SCHEMBL9548620 | 0.82 | HINT1 (0.42) | HINT1HSP90B1AHCYNT5EADORA2A | |
| SCHEMBL12237562 | 0.80 | HINT1 (0.39) | HINT1HSP90B1AHCYNT5EPNP | |
| SCHEMBL2524224 | 0.80 | HINT1 (0.39) | HINT1HSP90B1AHCYNT5EPNP | |
| SCHEMBL9548608 | 0.78 | — | — | |
| SCHEMBL9548704 | 0.78 | HINT1 (0.37) | HINT1HSP90B1AHCYNT5EPNP | |
| SCHEMBL9548867 | 0.76 | PDE3A (0.41) | NT5ELMNAPDE4DPDE3A |
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-5192749-A | Viricide, AIDS | SYNTEX (U.S.A.) INC. (US) | 1993-03-09 | — | — | US | disclosed |