Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
| ▸ | NOS2 | P35228 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 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 | |
|---|---|---|---|---|
| SCHEMBL19913884 | 0.79 | NOS3 (0.34) | NOS3NOS2NOS1SMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL18096131 | 0.77 | NOS3 (0.33) | NOS3NOS2LMNA | |
| SCHEMBL17840651 | 0.76 | PDE2A (0.33) | NOS3NOS2 | |
| SCHEMBL25322397 | 0.75 | ALDH1A1 (0.31) | L3MBTL1SMN1; SMN2HPGDALDH1A1LMNA | |
| SCHEMBL17840661 | 0.75 | AAK1 (0.32) | NOS3NOS2 | |
| SCHEMBL25318175 | 0.73 | SMN1; SMN2 (0.37) | L3MBTL1SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL25323256 | 0.71 | ATR (0.44) | L3MBTL1SMN1; SMN2KDM4EHPGDALDH1A1 | |
| SCHEMBL1760983 | 0.71 | DYRK1A (0.45) | NOS3NOS2NOS1DYRK1AL3MBTL1 | |
| SCHEMBL28026926 | 0.70 | HSP90AA1 (0.32) | SMN1; SMN2 | |
| SCHEMBL29486472 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104755465-A | Heterocyclic compounds | TAKEDA PHARMACEUTICAL | 2015-07-01 | — | — | CN | disclosed |