Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | RPA1 | P27694 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | XDH | P47989 | 4/20 | 0.43 |
| ▸ | ADH5 | P11766 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | PTPRCAP | Q14761 | 1/20 | 0.40 |
| ▸ | GP6 | Q9HCN6 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1289605 | 0.77 | ESR1 (0.68) | RPA1NPC1XDHADH5NOTUM | |
| SCHEMBL17091591 | 0.76 | PTPN11 (0.50) | KDM4ERPA1IDO1NPC1XDH | |
| SCHEMBL6598363 | 0.69 | KDM4E (0.50) | KDM4E | |
| SCHEMBL14187668 | 0.68 | LDHA (0.56) | KDM4ERPA1IDO1ADH5GP6 | |
| SCHEMBL31685132 | 0.67 | NQO2 (0.49) | KDM4ETP53RAB9ANPSR1 | |
| SCHEMBL27294564 | 0.67 | NQO2 (0.49) | KDM4ETP53RAB9ANPSR1 | |
| SCHEMBL10865183 | 0.67 | ALOX5 (0.47) | — | |
| SCHEMBL9984638 | 0.66 | ADH5 (0.95) | RPA1NPC1XDHADH5GP6 | |
| SCHEMBL2645811 | 0.65 | ADH5 (0.75) | RPA1NPC1XDHADH5TP53 | |
| SCHEMBL8295416 | 0.65 | RPA1 (1.00) | RPA1IDO1NPC1XDHADH5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2624695-B1 | NOVEL SUBSTITUTED QUINOLINE COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | NIVALIS THERAPEUTICS INC (US) | 2015-09-23 | — | — | EP | claimed |