Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11500986 | 0.76 | CYP1A2 (0.34) | CYP2C9CYP1A2CYP2D6ALDH1A1KCNN4 | |
| Benzylic Acid SCHEMBL7066 | 0.74 | CYP2C9 (0.74) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL8887549 | 0.74 | KCNN4 (0.33) | ALDH1A1KCNN4 | |
| Benzylic Acid SCHEMBL9568239 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL5705762 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL11049826 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL9181980 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL20957595 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL1680669 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL1681667 | 0.72 | CYP2C9 (0.71) | CYP2C9HTTSMN1; SMN2CYP1A2CYP2D6 |
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-4239901-A | ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1980-12-16 | — | — | US | disclosed |