Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.52 |
| ▸ | DHFR | P00374 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6308539 | 1.00 | GSTP1 (0.52) | GSTP1DHFRKDM4ECYP1A2ADORA2A | |
| SCHEMBL29830364 | 0.84 | HPRT1 (0.46) | CYP1A2ALDH1A1HSD17B10CYP1A1CYP1B1 | |
| SCHEMBL3193310 | 0.83 | GSTP1 (0.64) | GSTP1DHFRKDM4ECYP1A2ADORA2A | |
| SCHEMBL23443653 | 0.82 | PRKCZ (0.53) | KDM4EALDH1A1HSD17B10CYP3A4NPC1 | |
| SCHEMBL15271981 | 0.82 | HSD17B10 (0.43) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL29798181 | 0.82 | HSD17B10 (0.43) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL21068 | 0.82 | ALDH1A1 (0.46) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL30574434 | 0.82 | ALDH1A1 (0.46) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL29423352 | 0.82 | ALDH1A1 (0.46) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL28258564 | 0.82 | TSHR (0.44) | GSTP1MAPTSMN1; SMN2HPRT1ALOX5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117264200-A | Synthetic method and application of ethylenedioxythiophene bridged organic polymer | 天津理工大学 | 2023-12-22 | — | — | CN | claimed |
| CN-112778518-B | Amide-bridged organic polymer hole transport material and synthesis method and application thereof | 天津理工大学 | 2022-07-22 | — | — | CN | claimed |
| CN-111848415-B | Compound, organic electronic light-emitting device containing compound and application of compound | 北京鼎材科技有限公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-112778518-B | Amide-bridged organic polymer hole transport material and synthesis method and application thereof | 天津理工大学 | 2022-07-22 | — | — | CN | disclosed |