Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 6/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 11/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 9/20 | 0.33 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7432079 | 0.90 | NOS3 (0.38) | SPHK1SPHK2TNIKALDH1A1LMNA | |
| SCHEMBL7390644 | 0.85 | NOS3 (0.36) | ALDH1A1NOS3NOS2 | |
| SCHEMBL7398641 | 0.85 | KDM4E (0.38) | ALDH1A1LMNANOS3NOS2 | |
| SCHEMBL7396252 | 0.83 | ALDH1A1 (0.37) | SPHK1SPHK2TNIKALDH1A1LMNA | |
| SCHEMBL7398095 | 0.77 | KDM4E (0.38) | NOS3NOS2 | |
| SCHEMBL7594405 | 0.70 | NOS2 (0.44) | NOS3NOS2 | |
| SCHEMBL7382709 | 0.66 | NOS3 (0.40) | ALDH1A1LMNANOS3NOS2 | |
| SCHEMBL7394461 | 0.65 | NOS3 (0.31) | NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL7398282 | 0.65 | NOS3 (0.43) | NOS3NOS2 | |
| SCHEMBL7423018 | 0.64 | NOS3 (0.40) | ALDH1A1LMNANOS3NOS2 |
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-2000073312-A1 | COMPOUNDS | ASTRAZENECA AB (SE) | 2000-12-07 | — | — | WO | disclosed |