Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.59 |
| ▸ | CA7 | P43166 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.59 |
| ▸ | KDR | P35968 | 2/20 | 0.55 |
| ▸ | TNF | P01375 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9314378 | 0.92 | ALDH1A1 (0.59) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL9654462 | 0.92 | ALDH1A1 (0.59) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL11489364 | 0.91 | ALDH1A1 (0.57) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL11481523 | 0.89 | KDM4E (0.56) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL14124058 | 0.88 | CA1 (0.56) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL16233086 | 0.85 | HSD17B10 (0.55) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL2833452 | 0.83 | KDM4E (0.62) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL10370338 | 0.83 | KDM4E (0.62) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL1649282 | 0.83 | ALDH1A1 (0.62) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL14381820 | 0.82 | KDM4E (0.61) | KDM4EALDH1A1HPGDHSD17B10TDP1 |
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-1991006589-A1 | NEW ANTI-HIV COMPOUNDS BELONGING TO AURINTRICARBOXYLIC ACID | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) | 1991-05-16 | — | — | WO | disclosed |