Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | HMGCR | P04035 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | UBE2N | P61088 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3238108 | 0.82 | GSK3B (0.41) | MAPTKDM4EMEN1CYP3A4KMT2A | |
| SCHEMBL11708450 | 0.81 | AKR1C4 (0.60) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL24912687 | 0.79 | PLAU (0.43) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL30307562 | 0.79 | PLAU (0.43) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL30081529 | 0.78 | HSP90AB1 (0.41) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL25186187 | 0.78 | HSP90AB1 (0.41) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL28129742 | 0.77 | HSP90AB1 (0.47) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL17210813 | 0.76 | KDM4E (0.44) | HSP90AB1HMGCRHSD17B10MAPTKDM4E | |
| SCHEMBL29593387 | 0.75 | AKR1C3 (0.63) | HSD17B10KDM4EPTPN1AKR1C4AKR1C3 | |
| SCHEMBL4891804 | 0.75 | AKR1C3 (0.63) | HSD17B10KDM4EPTPN1AKR1C4AKR1C3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110256252-A | Acetophenone compounds, preparation method and the application for preparing treating cancer drug | 西北农林科技大学 | 2019-09-20 | — | — | CN | claimed |
| CN-105503788-A | 3-substituted propyl-2-alkene-1-ketone compound and application thereof | UNIV PLA 2ND MILITARY MEDICAL | 2016-04-20 | — | — | CN | disclosed |