Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27086807 | 0.86 | CA1 (0.40) | S1PR3ALDH1A1SMN1; SMN2TRPA1AAK1 | |
| SCHEMBL30695655 | 0.85 | TRPA1 (0.48) | S1PR3ALDH1A1LMNATRPA1CYP2D6 | |
| SCHEMBL30695653 | 0.83 | S1PR3 (0.47) | S1PR3ALDH1A1SMN1; SMN2TRPA1SLC6A3 | |
| SCHEMBL27811718 | 0.83 | S1PR3 (0.47) | S1PR3ALDH1A1SMN1; SMN2TRPA1SLC6A3 | |
| SCHEMBL30695660 | 0.80 | PPARG (0.43) | ALDH1A1LMNASMN1; SMN2TRPA1CA1 | |
| SCHEMBL18660957 | 0.80 | PPARG (0.43) | ALDH1A1LMNASMN1; SMN2TRPA1CA1 | |
| SCHEMBL18660810 | 0.80 | PPARG (0.43) | ALDH1A1LMNASMN1; SMN2TRPA1CA1 | |
| SCHEMBL18660958 | 0.80 | PPARG (0.43) | ALDH1A1LMNASMN1; SMN2TRPA1CA1 | |
| SCHEMBL18660808 | 0.80 | PPARG (0.43) | ALDH1A1LMNASMN1; SMN2TRPA1CA1 | |
| SCHEMBL851252 | 0.80 | GABRB1 (0.52) | CYP2D6SLC6A3SLC6A2SLC6A4 |
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-2387570-A1 | FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE | Amgen, Inc (US) | 2011-11-23 | — | — | EP | disclosed |
| WO-2010083246-A1 | FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE | AMGEN INC. (US) | 2010-07-22 | — | — | WO | disclosed |