Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | RHOA | P61586 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | WNT1 | P04628 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL19670212 | 0.88 | RHOA (0.45) | BRAFCREBBPBRD4CCR3RHOA | |
| SCHEMBL19670405 | 0.88 | BRAF (0.40) | BRAFCREBBPBRD4CCR3RHOA | |
| SCHEMBL19670429 | 0.88 | BRAF (0.40) | BRAFCNR1CREBBPBRD4CCR3 | |
| SCHEMBL19670388 | 0.87 | CACNA1G (0.46) | BRAFTHRBCACNA1GCACNA1HCACNA1I | |
| SCHEMBL16775979 | 0.84 | CREBBP (0.44) | BRAFCNR1CREBBPBRD4EGFR | |
| SCHEMBL19670174 | 0.84 | HDAC2 (0.39) | BRD4PDK1PDK2PDK3PDK4 | |
| SCHEMBL19670593 | 0.84 | JAK1 (0.38) | CNR1BRD4PDK1PDK2PDK3 | |
| SCHEMBL17618477 | 0.83 | BRAF (0.40) | BRAFCNR1CREBBPBRD4CCR3 | |
| SCHEMBL19670253 | 0.82 | MLLT1 (0.38) | CNR1CREBBPCACNA1H | |
| SCHEMBL19670252 | 0.82 | THRB (0.38) | BRD4PDK1PDK2PDK3PDK4 |
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 |