Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18481633 | 0.84 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL19660512 | 0.78 | MMP2 (0.35) | ACP3CYP2D6ALDH1A1MAPK1MEN1 | |
| SCHEMBL19832034 | 0.77 | ALDH1A1 (0.58) | ACP3SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL13085421 | 0.77 | CYP2A6 (0.38) | ACP3SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL29407540 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPK1MEN1KMT2ARXFP1 | |
| SCHEMBL1527448 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPK1MEN1KMT2ARXFP1 | |
| SCHEMBL22688319 | 0.71 | CYP1A1 (0.40) | ACP3CYP1B1CYP1A1CYP1A2 | |
| SCHEMBL30466637 | 0.70 | ALDH1A1 (0.54) | ALDH1A1MAPK1CYP1B1CYP1A1CYP1A2 | |
| SCHEMBL1527418 | 0.70 | ALDH1A1 (0.54) | ALDH1A1MAPK1CYP1B1CYP1A1CYP1A2 | |
| SCHEMBL2308079 | 0.70 | AKR1B1 (0.48) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018012780-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT | 덕산네오룩스 주식회사 | 2018-01-18 | — | — | WO | disclosed |