Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.70 |
| ▸ | SERPINE1 | P05121 | 6/20 | 0.61 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.57 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | ACLY | P53396 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | PPARA | Q07869 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7255416 | 0.86 | GRIK1 (0.67) | KDM4EALDH1A1 | |
| SCHEMBL1016189 | 0.85 | KDM4E (0.74) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| SCHEMBL27611956 | 0.83 | MAPT (0.72) | KDM4ESERPINE1ALDH1A1TP53GAA | |
| SCHEMBL9681911 | 0.83 | KDM4E (0.66) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| SCHEMBL7988908 | 0.82 | KDM4E (0.70) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| SCHEMBL7045036 | 0.82 | KDM4E (1.00) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| Hydrochloric Acid SCHEMBL6623261 | 0.81 | KDM4E (0.64) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| SCHEMBL28253565 | 0.81 | KMT2A (0.57) | KDM4EHSD17B10ALDH1A1CA1CA2 | |
| SCHEMBL6351321 | 0.81 | SERPINE1 (0.89) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 | |
| SCHEMBL11604753 | 0.81 | KDM4E (0.68) | KDM4EHSD17B10SERPINE1AKR1C4AKR1C3 |
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-2003055866-A1 | QUINAZOLINE AND QUINOLINE DERIVATIVE COMPOUNDS AS INHIBITORS OF PROLYLPEPTIDASE, INDUCERS OF APOPTOSIS AND CANCER TREATMENT AGENTS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-07-10 | — | — | WO | disclosed |