Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.76 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.76 |
| ▸ | FNTA | P49354 | 4/20 | 0.60 |
| ▸ | FNTB | P49356 | 4/20 | 0.60 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28538300 | 0.98 | ALDH1A1 (0.79) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL7220410 | 0.98 | ALDH1A1 (0.79) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL4962981 | 0.91 | ALDH1A1 (0.69) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL3269985 | 0.91 | ALDH1A1 (0.69) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL12986604 | 0.90 | ALDH1A1 (0.67) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL12986607 | 0.90 | ALDH1A1 (0.67) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL10988863 | 0.89 | ALDH1A1 (0.71) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL21051958 | 0.89 | ALDH1A1 (0.71) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL10988858 | 0.89 | ALDH1A1 (0.71) | ALDH1A1ALOX15FNTAFNTBPGGT1B | |
| SCHEMBL133908 | 0.89 | ALDH1A1 (0.96) | ALDH1A1ALOX15FNTAFNTBPGGT1B |
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-2012037069-A2 | UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2012-03-22 | — | — | WO | disclosed |