Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL9682603 | 0.75 | — | — | |
| SCHEMBL27682960 | 0.66 | — | — | |
| SCHEMBL2181934 | 0.66 | — | — | |
| SCHEMBL14671183 | 0.65 | ALDH1A1 (0.36) | ALDH1A1TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3202774 | 0.64 | — | — | |
| SCHEMBL789437 | 0.63 | — | — | |
| SCHEMBL4449479 | 0.62 | TDP1 (0.39) | ALDH1A1TDP1 | |
| SCHEMBL20327288 | 0.62 | CHRNB2 (0.43) | ALDH1A1TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL31484853 | 0.62 | CHRNB2 (0.34) | ALDH1A1TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL8848894 | 0.61 | — | — |
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-7173036-B2 | Inhibitors of macrophage migration inhibitory factor and methods for identifying the same | AVANIR PHARMACEUTICALS (US) | 2007-02-06 | — | — | US | disclosed |