Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP7 | P09237 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
| ▸ | MMP14 | P50281 | 1/20 | 0.34 |
| ▸ | MMP15 | P51511 | 1/20 | 0.34 |
| ▸ | MMP16 | P51512 | 1/20 | 0.34 |
| ▸ | MMP26 | Q9NRE1 | 1/20 | 0.34 |
| ▸ | CD4 | P01730 | 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 | |
|---|---|---|---|---|
| SCHEMBL8029313 | 0.86 | HTR6 (0.47) | ALDH1A1MMP2GAAHTR6MAPT | |
| SCHEMBL8465151 | 0.82 | MMP2 (0.43) | ALDH1A1KCNN4KCNA3MMP2GAA | |
| SCHEMBL28549773 | 0.71 | MMP2 (0.48) | ALDH1A1KCNN4KCNA3MMP2GAA | |
| SCHEMBL8465404 | 0.69 | HTR6 (0.51) | ALDH1A1KCNN4KCNA3HTR6MAPT | |
| SCHEMBL28556783 | 0.68 | MAPT (0.44) | ALDH1A1KCNN4KCNA3MMP2GAA | |
| SCHEMBL28556938 | 0.68 | MMP2 (0.43) | KCNN4KCNA3MMP2GAACA1 | |
| SCHEMBL28857559 | 0.68 | KCNN4 (0.52) | ALDH1A1KCNN4KCNA3MMP2GAA | |
| SCHEMBL25411880 | 0.67 | KDM4E (0.37) | ALDH1A1KCNN4KCNA3MMP2CRHBP | |
| SCHEMBL25411887 | 0.67 | KDM4E (0.37) | ALDH1A1KCNN4KCNA3MMP2CRHBP | |
| SCHEMBL14525250 | 0.67 | PAX8 (0.42) | ALDH1A1GAAHTR6MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6166031-A | Substituted tetralins, chromans and related compounds in the treatment of asthma | PFIZER INC, (US) | 2000-12-26 | — | — | US | disclosed |
| WO-1989003681-A1 | SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA | PFIZER INC. (US) | 1989-05-05 | — | — | WO | disclosed |