Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8634557 | 0.90 | ALDH1A1 (0.33) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL8908187 | 0.89 | ALDH1A1 (0.32) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL8636480 | 0.85 | ALDH1A1 (0.31) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL11122271 | 0.82 | ALDH1A1 (0.33) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL10641000 | 0.78 | SMN1; SMN2 (0.41) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL9298522 | 0.78 | SMN1; SMN2 (0.37) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL9356376 | 0.78 | SMN1; SMN2 (0.37) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL10039476 | 0.78 | KIF11 (0.31) | — | |
| SCHEMBL31072320 | 0.77 | SMN1; SMN2 (0.36) | ALDH1A1CA2POLBTYRSMN1; SMN2 | |
| SCHEMBL8631123 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5712403-A | CATALYST | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-01-27 | — | — | US | disclosed |
| US-5600032-A | OLIGOMERIZATION OF A CONJUGATED ALKADIENE IN PRESENCE OFPALLADIUM, PHOSPHORUS COMPLEX | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-02-04 | — | — | US | disclosed |