Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8010689 | 0.76 | ESR1 (0.38) | CA1CA4CA14CA3CA2 | |
| SCHEMBL8345206 | 0.69 | ESR1 (0.41) | ESR1ESR2LMNASMN1; SMN2TAAR1 | |
| SCHEMBL7999858 | 0.69 | ESR1 (0.41) | ESR1ESR2LMNASMN1; SMN2TAAR1 | |
| SCHEMBL6608641 | 0.67 | ASAH1 (0.37) | LMNAALDH1A1L3MBTL1KMT2A | |
| SCHEMBL8340631 | 0.65 | LMNA (0.40) | CA2ESR1ESR2LMNASMN1; SMN2 | |
| SCHEMBL7406212 | 0.65 | DAO (0.35) | SMN1; SMN2TAAR1ALDH1A1MAPTCYP2C19 | |
| SCHEMBL8008891 | 0.65 | LMNA (0.40) | CA2ESR1ESR2LMNASMN1; SMN2 | |
| SCHEMBL69344 | 0.60 | ESR1 (1.00) | CA1CA4CA14CA3CA2 | |
| SCHEMBL3873458 | 0.60 | ESR1 (1.00) | CA1CA4CA14CA3CA2 | |
| SCHEMBL13097331 | 0.59 | ESR1 (0.50) | CA2ESR1ESR2LMNATAAR1 |
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-0935597-A2 | DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY | WARNER-LAMBERT COMPANY (US) | 1999-08-18 | — | — | EP | disclosed |
| WO-1998019997-A2 | DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY | WARNER-LAMBERT COMPANY (US) | 1998-05-14 | — | — | WO | disclosed |