Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | XDH | P47989 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | BCL2 | P10415 | 1/20 | 0.49 |
| ▸ | BECN1 | Q14457 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14540723 | 0.86 | ALDH1A1 (0.57) | ALDH1A1XDHCA1CA2CA9 | |
| SCHEMBL23052349 | 0.85 | POLB (0.66) | ALDH1A1XDHPTGS2MAOAMAOB | |
| SCHEMBL23268895 | 0.80 | ALDH1A1 (0.64) | ALDH1A1XDHBCL2BECN1 | |
| SCHEMBL14540783 | 0.79 | KMT2A (0.64) | ALDH1A1CA1CA2CA9PTGS2 | |
| SCHEMBL14541215 | 0.79 | ALDH1A1 (0.55) | ALDH1A1BCL2BECN1POLB | |
| SCHEMBL14540722 | 0.78 | ALDH1A1 (0.55) | ALDH1A1XDHMAOAMAOBPOLB | |
| SCHEMBL14540721 | 0.76 | ALDH1A1 (0.66) | ALDH1A1XDHBCL2BECN1POLB | |
| SCHEMBL14540882 | 0.76 | CA1 (0.81) | CA1CA2CA9MAOAMAOB | |
| SCHEMBL14540883 | 0.74 | CA1 (0.78) | CA1CA2CA9MAOAMAOB | |
| SCHEMBL14541143 | 0.73 | KMT2A (0.70) | ALDH1A1CA1CA2CA9PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007038425-A2 | ANTI-VIRAL COMPOUINDS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2007-04-05 | — | — | WO | disclosed |