Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 7/20 | 0.37 |
| ▸ | HTR2C | P28335 | 7/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 4/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20632954 | 0.91 | FYN (0.37) | FYNRIPK1HTR2AHTR2CCYP1A2 | |
| SCHEMBL19706043 | 0.87 | FYN (0.38) | FYNRIPK1HTR2AHTR2CCYP1A2 | |
| SCHEMBL19365537 | 0.84 | CA2 (0.43) | RIPK1HTR2AHTR2CCA2CA9 | |
| SCHEMBL19670552 | 0.83 | FYN (0.38) | FYNHTR2AHTR2CCYP1A2CA2 | |
| SCHEMBL19669976 | 0.83 | HTR2A (0.52) | FYNRIPK1HTR2AHTR2CCYP1A2 | |
| SCHEMBL19670177 | 0.83 | FYN (0.36) | FYNRIPK1HTR2AHTR2CCYP1A2 | |
| SCHEMBL17618335 | 0.82 | TRPV1 (0.39) | FYNHTR2AHTR2CCYP1A2CA2 | |
| SCHEMBL16237553 | 0.81 | FYN (0.37) | FYNHTR2AHTR2CCYP1A2CA2 | |
| SCHEMBL20632034 | 0.80 | RHOA (0.41) | FYNHTR2AHTR2CCYP1A2CA2 | |
| SCHEMBL16776412 | 0.80 | FYN (0.41) | FYNHTR2AHTR2CCYP1A2CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2997029-B1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2019-01-09 | — | — | EP | disclosed |