Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.69 |
| ▸ | PRKDC | P78527 | 1/20 | 0.62 |
| ▸ | ERN1 | O75460 | 3/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.44 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1539323 | 1.00 | ALDH1A1 (0.69) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL2037836 | 0.92 | PRKDC (0.74) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL18270047 | 0.88 | PRKDC (0.81) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL30665931 | 0.88 | PRKDC (0.81) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL1571567 | 0.86 | PRKDC (0.56) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL13271943 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL8715769 | 0.84 | ALDH1A1 (0.50) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL20140184 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL10849623 | 0.84 | ALDH1A1 (0.86) | ALDH1A1KDM4ETSHRTDP1PRKDC | |
| SCHEMBL2859718 | 0.84 | PRKDC (0.58) | ALDH1A1KDM4ETSHRTDP1PRKDC |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114853652-B | Sulfonium salt compound, preparation method and application thereof, and cationic UV (ultraviolet) curing adhesive | 韦尔通科技股份有限公司 | 2023-08-29 | — | — | CN | disclosed |
| CN-111094262-B | 1, 3-dioxane-4, 6-diketone compound, preparation method thereof, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2022-12-20 | — | — | CN | disclosed |
| CN-114853652-A | Sulfonium salt compound, preparation method and application thereof, and cationic UV (ultraviolet) curing adhesive | 韦尔通(厦门)科技股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-109843874-B | Phthalazine derivatives useful as inhibitors of PARP1, PARP2 and/or tubulin for the treatment of cancer | 加利福尼亚大学董事会 | 2022-05-27 | — | — | CN | disclosed |