Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | USP2 | O75604 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | DHFR | P00374 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29824145 | 1.00 | APLNR (0.51) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL1265017 | 0.84 | CYP3A4 (0.52) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL28595894 | 0.82 | CYP1A2 (0.55) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL24636086 | 0.82 | APLNR (0.56) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL23598634 | 0.82 | NPC1 (0.47) | ALDH1A1HSD17B10LMNATSHRTP53 | |
| SCHEMBL4791564 | 0.78 | KDM4C (0.60) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL23578702 | 0.78 | ALDH1A1 (0.51) | ALDH1A1USP2LMNATSHRMAPT | |
| SCHEMBL5667628 | 0.78 | APLNR (0.55) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL12898531 | 0.77 | APLNR (0.54) | APLNRCYP1A2CYP3A4CLK4ALDH1A1 | |
| SCHEMBL10172668 | 0.75 | KDM4E (0.53) | APLNRALDH1A1HSD17B10LMNAKDM4C |
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 |
|---|---|---|---|---|---|---|---|
| EP-4083043-A1 | NOVEL ORGANIC ELECTRON TRANSFER MEDIATOR AND DEVICE COMPRISING SAME | I-SENS, INC. (KR) | 2022-11-02 | — | — | EP | disclosed |
| WO-2021133144-A1 | NOVEL ORGANIC ELECTRON TRANSFER MEDIATOR AND DEVICE COMPRISING SAME | 주식회사 아이센스 | 2021-07-01 | — | — | WO | disclosed |