Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | RHOA | P61586 | 2/20 | 0.37 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
| ▸ | WNT1 | P04628 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 4/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 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 | |
|---|---|---|---|---|
| SCHEMBL19365415 | 0.91 | BRAF (0.41) | BRAFCCR3CREBBPBRD4RHOA | |
| SCHEMBL19670170 | 0.88 | BRAF (0.40) | BRAFCCR3NPC1RAB9ACREBBP | |
| SCHEMBL19670212 | 0.88 | RHOA (0.45) | BRAFCCR3NPC1RAB9ACREBBP | |
| SCHEMBL19670405 | 0.88 | BRAF (0.40) | BRAFCCR3NPC1RAB9ACREBBP | |
| SCHEMBL19670393 | 0.87 | ABL1 (0.42) | — | |
| SCHEMBL17618491 | 0.83 | RHOA (0.41) | BRAFCCR3CREBBPBRD4RHOA | |
| SCHEMBL19670251 | 0.82 | MLLT1 (0.39) | NPC1RAB9ACREBBPCNR1 | |
| SCHEMBL19669985 | 0.82 | KARS1 (0.43) | GSK3BDYRK1A | |
| SCHEMBL19670263 | 0.81 | DHFR (0.37) | NPC1RAB9A | |
| SCHEMBL19365667 | 0.80 | RHOA (0.43) | BRAFCCR3NPC1RAB9ACREBBP |
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 |