Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 8/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 4/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1997280 | 1.00 | ELANE (0.44) | ELANEPARP1ACHEDHODHBCHE | |
| SCHEMBL9268529 | 0.84 | TDP1 (0.48) | ELANEPARP1ACHEDHODHBCHE | |
| SCHEMBL28056655 | 0.84 | ELANE (0.44) | ELANEPARP1ACHEDHODHBCHE | |
| SCHEMBL3337344 | 0.79 | PARP1 (0.44) | ELANEPARP1ACHEBCHEGRIN1 | |
| SCHEMBL30013654 | 0.79 | PARP1 (0.44) | ELANEPARP1ACHEBCHEGRIN1 | |
| SCHEMBL24960900 | 0.78 | ELANE (0.40) | ELANEPARP1ACHEDHODHBCHE | |
| SCHEMBL8068675 | 0.77 | ELANE (0.48) | ELANEPARP1KDM4EALDH1A1 | |
| SCHEMBL4167763 | 0.76 | KDM4E (0.35) | KDM4EALDH1A1 | |
| SCHEMBL7070941 | 0.76 | TDP1 (0.38) | PARP1KDM4EALDH1A1TDP1 | |
| SCHEMBL1995692 | 0.76 | PARP1 (0.42) | ELANEPARP1ACHETDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115362003-A | Diacylglycerol kinase modulating compounds | 卡尔那生物科学株式会社 | 2022-11-18 | — | — | CN | disclosed |
| WO-2022148879-A1 | QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF ACKR3 | STICHTING VU (NL) | 2022-07-14 | — | — | WO | disclosed |