Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CDC25A | P30304 | 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 | |
|---|---|---|---|---|
| SCHEMBL16239185 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL19244489 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL28181575 | 0.77 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL16236142 | 0.70 | ALDH1A1 (0.53) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL16235966 | 0.70 | NPC1 (0.43) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL16239303 | 0.70 | TYMS (0.41) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL4918564 | 0.70 | TSHR (0.43) | ALDH1A1HPGDHSD17B10CYP1A2ACHE | |
| SCHEMBL18113162 | 0.70 | ACHE (0.52) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL18113159 | 0.69 | TSHR (0.65) | ALDH1A1HPGDKDM4EHSD17B10TP53 | |
| SCHEMBL10398535 | 0.69 | CA12 (0.59) | ALDH1A1KDM4EHSD17B10CYP1A2ACHE |
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-2803679-A1 | Catalyst components for the polymerization of olefins | Basell Poliolefine Italia S.r.l. (IT) | 2014-11-19 | — | — | EP | disclosed |