Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | CES1 | P23141 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | CA1 | P00915 | 3/20 | 0.57 |
| ▸ | CA2 | P00918 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CRHBP | P24387 | 1/20 | 0.54 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA3 | P07451 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA5A | P35218 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL584608 | 0.86 | MAPK1 (0.62) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL3282793 | 0.81 | HPGD (0.50) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20474525 | 0.81 | ATM (0.57) | CES1GAATDP1ALDH1A1CES2 | |
| SCHEMBL29042306 | 0.81 | ALDH1A1 (0.60) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL11098319 | 0.80 | MAPK1 (0.55) | MAPK1CES1GAACA1CA2 | |
| Hydrochloric Acid SCHEMBL11684654 | 0.80 | CRHBP (0.58) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL8002619 | 0.80 | MAPK1 (0.55) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL5390211 | 0.80 | MAPK1 (0.55) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL11793491 | 0.80 | MAPK1 (0.55) | MAPK1CES1GAACA1CA2 | |
| SCHEMBL11684646 | 0.80 | ALDH1A1 (0.59) | MAPK1CES1GAACA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2909192-B1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2017-05-17 | — | — | EP | disclosed |
| EP-2425878-A1 | Protective coating compostition | Nederlandse Organisatie voor toegepast -natuurwetenschappelijk onderzoek TNO (NL) | 2012-03-07 | — | — | EP | disclosed |