Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | MELK | Q14680 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4618673 | 0.89 | KDM4E (0.53) | MELKCA12CA1CA2CA7 | |
| SCHEMBL701717 | 0.86 | APLNR (0.47) | APLNRADRA1ATAAR1MELKCYP3A4 | |
| SCHEMBL24075695 | 0.85 | APLNR (0.50) | APLNRCA12CA1CA2CA7 | |
| SCHEMBL29350908 | 0.85 | APLNR (0.63) | APLNRADRA1ATAAR1HTR2BCA12 | |
| SCHEMBL153750 | 0.85 | APLNR (0.63) | APLNRADRA1ATAAR1HTR2BCA12 | |
| Hydrochloric Acid SCHEMBL2944977 | 0.84 | MELK (0.46) | APLNRADRA1ATAAR1MELKALDH1A1 | |
| SCHEMBL10141788 | 0.84 | APLNR (0.46) | APLNRADRA1ATAAR1MELKHTR2B | |
| SCHEMBL6482271 | 0.83 | CNR1 (0.48) | APLNRADRA1ATAAR1HTR2BALDH1A1 | |
| Hydrochloric Acid SCHEMBL1197172 | 0.83 | APLNR (0.61) | APLNRADRA1ATAAR1HTR2BCA12 | |
| SCHEMBL12844149 | 0.82 | APLNR (0.47) | APLNRADRA1ATAAR1CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015171527-A1 | PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS | GLOBAL BLOOD THERAPEUTICS, INC. (US) | 2015-11-12 | — | — | WO | disclosed |
| EP-0276631-B1 | WETTABLE SURFACE MODIFIED CONTACT LENS FABRICATED FROM AN OXIRANE CONTAINING HYDROPHOBIC POLYMER | CIBA-GEIGY AG (CH) | 1991-05-29 | — | — | EP | disclosed |
| EP-0276631-A1 | Wettable surface modified contact lens fabricated from an oxirane containing hydrophobic polymer | CIBA-GEIGY AG (CH) | 1988-08-03 | — | — | EP | disclosed |
| US-4734475-A | Wettable surface modified contact lens fabricated from an oxirane containing hydrophobic polymer | CIBA-GEIGY CORPORATION (US) | 1988-03-29 | — | — | US | disclosed |