Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RHOA | P61586 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 6/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | ALPG | P10696 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17618598 | 1.00 | RHOA (0.43) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL16249980 | 1.00 | RHOA (0.43) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL20632009 | 0.95 | RHOA (0.45) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL16776225 | 0.95 | CREBBP (0.43) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL16775764 | 0.91 | IMPDH2 (0.44) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL16775784 | 0.91 | IMPDH2 (0.44) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL17618491 | 0.89 | RHOA (0.41) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL17618770 | 0.89 | CREBBP (0.42) | RHOACNR1BRAFCREBBPBRD4 | |
| SCHEMBL16775765 | 0.89 | RHOA (0.44) | RHOABRAFCREBBPBRD4CASR | |
| SCHEMBL19865069 | 0.89 | RHOA (0.48) | RHOABRAFCREBBPBRD4CASR |
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-9765075-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-09-19 | — | — | US | disclosed |