Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.37 |
| ▸ | RHOA | P61586 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16776401 | 0.84 | BRAF (0.42) | BRAFHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL17618849 | 0.78 | BRAF (0.41) | BRAFHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL19365697 | 0.78 | DYRK1A (0.40) | — | |
| SCHEMBL19365853 | 0.78 | RHOA (0.38) | BRAFCREBBPRHOAROCK2IMPDH2 | |
| SCHEMBL19365610 | 0.77 | BRAF (0.42) | BRAFCREBBPRHOAROCK2IMPDH2 | |
| SCHEMBL19365600 | 0.77 | RHOA (0.43) | BRAFRHOAROCK2IMPDH2LIMK2 | |
| SCHEMBL19365820 | 0.77 | RHOA (0.43) | BRAFRHOAROCK2IMPDH2LIMK2 | |
| SCHEMBL19365224 | 0.76 | RHOA (0.35) | BRAFRHOA | |
| SCHEMBL19670429 | 0.75 | BRAF (0.40) | BRAFCREBBPRHOAROCK2IMPDH2 | |
| SCHEMBL1815620 | 0.75 | HTR2C (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |