Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| SCHEMBL28712168 | 0.92 | ALDH1A1 (0.42) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 | |
| SCHEMBL28167314 | 0.86 | AGXT (0.43) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 | |
| SCHEMBL3541730 | 0.84 | ALDH1A1 (0.49) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 | |
| SCHEMBL29424653 | 0.82 | KDM4E (0.41) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 | |
| SCHEMBL16534423 | 0.81 | FAAH (0.44) | ALDH1A1KDM4EAGXTLOXL2MEN1 | |
| SCHEMBL10878681 | 0.81 | AGXT (0.42) | ALDH1A1KDM4ESMN1; SMN2AGXTLOXL2 | |
| SCHEMBL4678729 | 0.81 | LOXL2 (0.50) | KDM4ESMN1; SMN2AGXTLOXL2TSHR | |
| SCHEMBL18762013 | 0.80 | POLB (0.47) | ALDH1A1KDM4ERAB9ANPC1AGXT | |
| SCHEMBL15635414 | 0.78 | POLB (0.49) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 | |
| SCHEMBL30043386 | 0.77 | CYP2A6 (0.48) | ALDH1A1KDM4ESMN1; SMN2RAB9ANPC1 |
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-114040959-A | Photochromic and electrochromic diarylethene compounds with improved photostability and solubility | 首诺加拿大公司 | 2022-02-11 | — | — | CN | disclosed |