Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 2/20 | 0.36 |
| ▸ | CPT1A | P50416 | 1/20 | 0.36 |
| ▸ | CTPS1 | P17812 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | CCNK | O75909 | 1/20 | 0.34 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | RPLP1 | P05386 | 1/20 | 0.33 |
| ▸ | RPLP0 | P05388 | 1/20 | 0.33 |
| ▸ | RPS17 | P08708 | 1/20 | 0.33 |
| ▸ | RPSA | P08865 | 1/20 | 0.33 |
| ▸ | RPS2 | P15880 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670535 | 0.98 | GSK3B (0.38) | GSK3BDYRK1AATRCPT1ACTPS1 | |
| SCHEMBL19670520 | 0.89 | CPT1A (0.37) | GSK3BDYRK1AATRCPT1ACTPS1 | |
| SCHEMBL19706241 | 0.89 | HDAC2 (0.35) | GSK3BDYRK1AATRCPT1ACTPS1 | |
| SCHEMBL19364891 | 0.88 | MCHR1 (0.42) | ATRCPT1AHDAC2MCHR1GRM5 | |
| SCHEMBL19365583 | 0.87 | ABL1 (0.38) | GSK3BDYRK1AATRHDAC2GRM5 | |
| SCHEMBL19365794 | 0.86 | ATR (0.38) | GSK3BATRCPT1AGRM5 | |
| SCHEMBL19364834 | 0.85 | ALDH1A1 (0.39) | GSK3BDYRK1AATRHDAC2 | |
| SCHEMBL19670409 | 0.85 | PRMT5 (0.42) | ATRGRM5 | |
| SCHEMBL19365309 | 0.85 | CNR2 (0.40) | GSK3BATRHDAC2GRM5 | |
| SCHEMBL19365295 | 0.85 | GSK3B (0.39) | GSK3BDYRK1AATRCTPS1GRM5 |
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 |