Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 11/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.51 |
| ▸ | MAPT | P10636 | 8/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3252939 | 0.94 | BRD4 (0.45) | ALDH1A1HSD17B10L3MBTL1HPGDESR1 | |
| SCHEMBL3246232 | 0.91 | MAPT (0.46) | ALDH1A1HSD17B10L3MBTL1HPGDESR1 | |
| SCHEMBL3249676 | 0.91 | POLB (0.47) | ALDH1A1HSD17B10HPGDMAPK1POLB | |
| SCHEMBL3246156 | 0.90 | MAPT (0.45) | ALDH1A1HSD17B10L3MBTL1HPGDESR1 | |
| SCHEMBL3253968 | 0.90 | PKM (0.49) | ALDH1A1HSD17B10HPGDMAPK1POLB | |
| SCHEMBL3251809 | 0.90 | MAPT (0.44) | ALDH1A1HSD17B10L3MBTL1HPGDESR1 | |
| SCHEMBL3255510 | 0.90 | BRD4 (0.54) | ALDH1A1HSD17B10HPGDESR1MAPK1 | |
| SCHEMBL3249397 | 0.87 | ALDH1A1 (0.44) | ALDH1A1HSD17B10MAPK1POLBTDP1 | |
| SCHEMBL3250340 | 0.87 | ALDH1A1 (0.55) | ALDH1A1HSD17B10L3MBTL1HPGDESR1 | |
| SCHEMBL3243020 | 0.87 | PKM (0.48) | ALDH1A1HSD17B10HPGDMAPK1POLB |
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-1899335-B1 | PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS | PF MEDICAMENT (FR) | 2010-05-19 | — | — | EP | claimed |