Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16681572 | 0.79 | ALDH1A3 (0.40) | ALDH1A1ALDH1A3ALDH3A1HSD17B10KDM4E | |
| SCHEMBL670230 | 0.77 | ALDH1A1 (0.59) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| Ethane SCHEMBL2154475 | 0.76 | ALDH1A1 (0.57) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL25371194 | 0.76 | ALDH1A1 (0.57) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL14143605 | 0.76 | ALDH1A1 (0.57) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL16976598 | 0.73 | ALDH1A1 (0.53) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL25688492 | 0.73 | ALDH1A1 (0.53) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL1245777 | 0.73 | ALDH1A1 (0.53) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL27509313 | 0.73 | ALDH1A1 (0.53) | ALDH1A1VCAM1CYP1A2ALDH1A3ALDH3A1 | |
| SCHEMBL40676 | 0.72 | ALDH1A1 (0.57) | ALDH1A1VCAM1CYP1A2ALDH1A3HSD17B10 |
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-0121753-A2 | 1-(1,3-Dioxolan-2-ylmethyl)-azoles, their salts, processes for their preparation and pharmaceutical compositions containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-10-17 | — | — | EP | disclosed |