Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8917172 | 0.85 | TAAR1 (0.36) | ALDH1A1GFERCA1CA2CA7 | |
| SCHEMBL457740 | 0.82 | CA1 (0.35) | ALDH1A1GFERCA1CA2CA7 | |
| SCHEMBL28725283 | 0.80 | IDO1 (0.35) | ALDH1A1CA1CA2CA7CA9 | |
| SCHEMBL7390049 | 0.80 | ABCB11 (0.36) | ALDH1A1DYRK1ACA1CA2CA7 | |
| SCHEMBL8627266 | 0.80 | IDO1 (0.42) | ALDH1A1GFERCA1CA2CA7 | |
| SCHEMBL3918671 | 0.80 | TAAR1 (0.39) | ALDH1A1CA1CA2CA7CA9 | |
| SCHEMBL7400862 | 0.78 | DRD2 (0.35) | CA1CA2CA7CA9CA12 | |
| SCHEMBL18706270 | 0.78 | SLC6A4 (0.40) | ALDH1A1 | |
| SCHEMBL7386695 | 0.77 | CYP2D6 (0.41) | CA1CA2CA7CA9CA12 | |
| SCHEMBL7231639 | 0.77 | CHRM2 (0.39) | CA1CA2CA7CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113966326-A | Water soluble adjuvants | 大日本住友制药株式会社 | 2022-01-21 | — | — | CN | disclosed |