Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.31 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.30 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.30 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20632004 | 0.81 | PHGDH (0.36) | ACP1CTSKKCNH2RPS6KB1AKT1 | |
| SCHEMBL20632146 | 0.77 | TRPA1 (0.35) | ACP1ALDH1A1HPGDCTSKKCNH2 | |
| SCHEMBL20631488 | 0.73 | GRIN1 (0.34) | ACP1ALDH1A1L3MBTL1CTSKKCNH2 | |
| SCHEMBL20632673 | 0.65 | CA2 (0.36) | ALDH1A1KDM4EADORA2ACNR2BRD4 | |
| SCHEMBL20632404 | 0.65 | GAA (0.38) | ACP1GAALMNATRPV4 | |
| SCHEMBL20631925 | 0.65 | ADORA2A (0.35) | ACP1ALDH1A1KDM4EHPGDCTSK | |
| SCHEMBL20632852 | 0.65 | TLR8 (0.35) | ACP1L3MBTL1CTSKKCNH2RPS6KB1 | |
| SCHEMBL19705998 | 0.64 | TRPA1 (0.38) | ACP1RPS6KB1AKT1ADORA2ATRPA1 | |
| SCHEMBL20633233 | 0.64 | KMT2A (0.36) | ALDH1A1L3MBTL1KDM4EHPGDADORA2A | |
| SCHEMBL20632687 | 0.64 | GRIN1 (0.31) | — |
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 |