Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | AR | P10275 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 9/20 | 0.43 |
| ▸ | NPC1 | O15118 | 8/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4514691 | 0.81 | AURKA (0.41) | SMN1; SMN2KCNH2ALDH1A1 | |
| SCHEMBL4591121 | 0.80 | AURKA (0.35) | KCNH2 | |
| SCHEMBL4510262 | 0.77 | PDE9A (0.51) | — | |
| SCHEMBL4590830 | 0.72 | BCHE (0.45) | TP53RAB9AMAPTKCNH2LMNA | |
| SCHEMBL18674597 | 0.67 | RAB9A (0.84) | SMN1; SMN2ARTP53ALOX15HSD17B10 | |
| SCHEMBL17266249 | 0.67 | SMN1; SMN2 (1.00) | SMN1; SMN2ARTP53ALOX15HSD17B10 | |
| SCHEMBL3004754 | 0.67 | SMN1; SMN2 (1.00) | SMN1; SMN2ARTP53ALOX15HSD17B10 | |
| SCHEMBL1353660 | 0.66 | CDK4 (0.63) | CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL18674671 | 0.65 | AR (0.97) | SMN1; SMN2ARTP53ALOX15HSD17B10 | |
| SCHEMBL4589851 | 0.65 | LMNA (0.45) | MAPTCYP1A2CYP2C9CYP2C19HPGD |
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-2008055959-A1 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS N.V. (BE) | 2008-05-15 | — | — | WO | disclosed |