Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL47344 | 0.76 | ALDH1A1 (0.36) | ALDH1A1CA1CA2POLBSMN1; SMN2 | |
| SCHEMBL92115 | 0.71 | — | — | |
| SCHEMBL16640879 | 0.71 | — | — | |
| SCHEMBL865707 | 0.67 | THRB (0.32) | — | |
| SCHEMBL1950932 | 0.66 | — | — | |
| SCHEMBL15413473 | 0.65 | — | — | |
| SCHEMBL28087298 | 0.65 | ALDH1A1 (0.45) | ALDH1A1CA1CA2POLBSMN1; SMN2 | |
| SCHEMBL16640889 | 0.64 | ALDH1A1 (0.36) | ALDH1A1POLB | |
| SCHEMBL30451082 | 0.64 | THRB (0.34) | — | |
| SCHEMBL30450888 | 0.64 | THRB (0.34) | — |
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-20150105843-A1 | METAL COMPLEXES COMPRISING CONDENSED HETEROAROMATIC RINGS | UDC IRELAND LIMITED (IE) | 2015-04-16 | — | — | US | disclosed |