Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | POLB | P06746 | 4/20 | 0.32 |
| ▸ | GLA | P06280 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CFD | P00746 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2722243 | 0.84 | KDM4E (0.35) | MAPTPOLBGLAKDM4E | |
| SCHEMBL2723798 | 0.83 | HSD17B10 (0.33) | MAPTPOLBGLAKDM4EGAA | |
| SCHEMBL27850349 | 0.80 | GRM5 (0.40) | ALOX5LMNAMAPTPOLBGLA | |
| SCHEMBL28783444 | 0.79 | ALOX5 (0.36) | ALOX5LMNAMAPTPOLBGLA | |
| SCHEMBL27543527 | 0.79 | KDM4E (0.39) | ALOX5LMNAMAPTKDM4ETDP1 | |
| SCHEMBL27517890 | 0.75 | ATR (0.39) | ALOX5GLACYP19A1HTTALDH1A1 | |
| SCHEMBL156162 | 0.75 | IDO1 (0.36) | MAPTPOLBTDP1NPC1ALDH1A1 | |
| SCHEMBL29948393 | 0.75 | IDO1 (0.36) | MAPTPOLBTDP1NPC1ALDH1A1 | |
| SCHEMBL27543750 | 0.75 | NQO2 (0.33) | ALOX5MAPK1 | |
| SCHEMBL17753601 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103153997-B | Quinazoline derivatives | MERCK PATENT GMBH | 2015-04-29 | — | — | CN | disclosed |
| CN-103429572-A | Tetra-substituted cyclohexyl compounds as kinase inhibitors | NOVARTIS AG | 2013-12-04 | — | — | CN | disclosed |
| CN-103153997-A | Quinazoline derivatives | MERCK PATENT GMBH | 2013-06-12 | — | — | CN | disclosed |
| CN-103080106-A | Cyclic ether compounds useful as kinase inhibitors | NOVARTIS AG | 2013-05-01 | — | — | CN | disclosed |