Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.57 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5759689 | 0.91 | ALDH1A1 (0.69) | ALDH1A1HPGDPTGS2PTGS1PIN1 | |
| SCHEMBL6495602 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HPGDPTGS2PTGS1SMN1; SMN2 | |
| SCHEMBL14692202 | 0.78 | PTGS2 (0.63) | ALDH1A1HPGDPTGS2PTGS1SMN1; SMN2 | |
| SCHEMBL27653921 | 0.77 | HPGD (0.58) | ALDH1A1HPGDPIN1SMN1; SMN2 | |
| SCHEMBL20376677 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HPGDPTGS2PTGS1SMN1; SMN2 | |
| SCHEMBL27653935 | 0.75 | CYP1A2 (0.42) | ALDH1A1HPGDPIN1SMN1; SMN2 | |
| SCHEMBL27653989 | 0.70 | TAAR1 (0.62) | ALDH1A1HPGDPIN1SMN1; SMN2 | |
| SCHEMBL27633484 | 0.68 | KDM4E (0.37) | ALDH1A1HPGDPIN1 | |
| SCHEMBL5762947 | 0.67 | KDM4E (0.62) | ALDH1A1HPGDPIN1SMN1; SMN2 | |
| SCHEMBL4752688 | 0.66 | HPGD (0.41) | ALDH1A1HPGDPTGS2PTGS1PIN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100427472-C | Aryl-heteroaromatic compounds, compositions containing them and their use | AVENTIS PHARMA SA (FR) | 2008-10-22 | — | — | CN | claimed |
| CN-1829697-A | Aryl-heteroaromatic products, compositions containing same and use thereof | AVENTIS PHARMA SA (FR) | 2006-09-06 | — | — | CN | claimed |
| CN-100427472-C | Aryl-heteroaromatic compounds, compositions containing them and their use | AVENTIS PHARMA SA (FR) | 2008-10-22 | — | — | CN | disclosed |
| CN-1829697-A | Aryl-heteroaromatic products, compositions containing same and use thereof | AVENTIS PHARMA SA (FR) | 2006-09-06 | — | — | CN | disclosed |