Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TOP1 | P11387 | 1/20 | 0.30 |
| ▸ | TOP2A | P11388 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21942071 | 0.96 | CYP1A1 (0.35) | CYP1A1CYP1B1HRH4HSD17B10CASP1 | |
| SCHEMBL22277007 | 0.94 | CYP1A1 (0.36) | CYP1A1CYP1B1HRH4HSD17B10CASP1 | |
| SCHEMBL19831775 | 0.89 | CYP1A1 (0.36) | CYP1A1CYP1B1HRH4HSD17B10CASP1 | |
| SCHEMBL21942098 | 0.88 | TUBB4A (0.34) | CYP1A1CYP1B1DHODHCYP1A2GSR | |
| SCHEMBL19831894 | 0.85 | CYP1A1 (0.32) | CYP1A1CYP1B1LIMK1 | |
| SCHEMBL21941898 | 0.84 | HRH4 (0.40) | HRH4HSD17B10CASP1DHODHKDM4E | |
| SCHEMBL17991026 | 0.84 | ALDH1A1 (0.41) | CYP1A1CYP1B1HSD17B10CASP1KDM4E | |
| SCHEMBL21942055 | 0.84 | ALOX5 (0.34) | CYP1A1CYP1B1 | |
| SCHEMBL19831892 | 0.83 | TUBB4A (0.32) | DHODH | |
| SCHEMBL21942099 | 0.83 | GSR (0.32) | CYP1A1CYP1B1CYP1A2GSR |
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-2020085793-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME | 덕산네오룩스 주식회사 | 2020-04-30 | — | — | WO | disclosed |