Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CPN1 | P15169 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8005489 | 1.00 | TAAR1 (0.35) | TAAR1PDE4BCYP11B2EPHX2ALDH1A1 | |
| SCHEMBL1072300 | 0.86 | TAAR1 (0.38) | TAAR1EPHX2ALDH1A1MAPK1LMNA | |
| SCHEMBL18669321 | 0.86 | TAAR1 (0.38) | TAAR1EPHX2ALDH1A1MAPK1LMNA | |
| SCHEMBL17099260 | 0.81 | GRM5 (0.40) | TAAR1PDE4BEPHX2ALDH1A1LMNA | |
| SCHEMBL8010277 | 0.79 | MEN1 (0.49) | PDE4BALDH1A1MEN1KMT2A | |
| SCHEMBL20477490 | 0.79 | MEN1 (0.49) | PDE4BALDH1A1MEN1KMT2A | |
| SCHEMBL8005512 | 0.79 | KMT2A (0.36) | TAAR1EPHX2LMNASMN1; SMN2MEN1 | |
| SCHEMBL5793762 | 0.76 | EPHX2 (0.35) | EPHX2 | |
| SCHEMBL16530276 | 0.76 | EPHX2 (0.35) | EPHX2 | |
| SCHEMBL31618749 | 0.75 | HPGD (0.46) | PDE4BALDH1A1SMN1; SMN2MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009108507-A1 | THERAPEUTIC COMPOUNDS | MERCK & CO., INC. (US) | 2009-09-03 | — | — | WO | disclosed |