Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.50 |
| ▸ | CA1 | P00915 | 8/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2514721 | 0.78 | ALDH1A1 (0.47) | CA2ALDH1A1KDM4EPOLBGAA | |
| SCHEMBL5172577 | 0.77 | CA2 (0.70) | CA2CA1CA12CA9 | |
| SCHEMBL5172574 | 0.77 | CA2 (0.70) | CA2CA1CA12CA9 | |
| SCHEMBL5173180 | 0.77 | CA2 (0.48) | CA2CA1CA12CA9 | |
| SCHEMBL23440037 | 0.72 | ALDH1A1 (0.69) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL1533823 | 0.72 | ALDH1A1 (0.69) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL12201410 | 0.71 | USP30 (0.41) | — | |
| SCHEMBL19332495 | 0.70 | CA2 (0.43) | CA2CA1CA12CA9ALDH1A1 | |
| SCHEMBL15631042 | 0.69 | ALOX5 (0.49) | CA2CA1ALDH1A1 | |
| SCHEMBL15631043 | 0.69 | ALOX5 (0.49) | CA2CA1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1781602-A1 | 4-SULFONYL-SUBSTITUTED BENZOYLALANINE DERIVATIVES USEFUL AS KYNURENINE-AMINOTRANSFERASE INHIBITORS | PELLICCIARI, Roberto (IT) | 2007-05-09 | — | — | EP | claimed |
| WO-2006013085-A1 | 4-SULFONYL-SUBSTITUTED BENZOYLALANINE DERIVATES USEFUL AS KYNURENINE-AMINOTRANSFERASE INHIBITORS | PELLICCIARI ROBERTO (IT) | 2006-02-09 | — | — | WO | claimed |
| EP-1781602-A1 | 4-SULFONYL-SUBSTITUTED BENZOYLALANINE DERIVATIVES USEFUL AS KYNURENINE-AMINOTRANSFERASE INHIBITORS | PELLICCIARI, Roberto (IT) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006013085-A1 | 4-SULFONYL-SUBSTITUTED BENZOYLALANINE DERIVATES USEFUL AS KYNURENINE-AMINOTRANSFERASE INHIBITORS | PELLICCIARI ROBERTO (IT) | 2006-02-09 | — | — | WO | disclosed |