Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16437552 | 0.92 | NQO1 (0.36) | NQO1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL17879504 | 0.85 | CA1 (0.40) | NQO1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL17954610 | 0.85 | NQO1 (0.40) | NQO1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL17431172 | 0.80 | PGR (0.37) | NQO1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL16437551 | 0.74 | MAP3K9 (0.44) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL16437710 | 0.74 | CA1 (0.47) | CA1CA2CA4CA6NTRK1 | |
| SCHEMBL16437554 | 0.73 | PNMT (0.46) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL29454006 | 0.73 | MAOA (0.43) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL29177903 | 0.73 | PNMT (0.44) | NQO1KDM4EALDH1A1MAPTHPGD | |
| Fluorene SCHEMBL11029824 | 0.73 | NQO1 (0.47) | NQO1KDM4EALDH1A1MAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-9755157-B2 | Organic compound and organic optoelectric device and display device | CHEIL INDUSTRIES, INC. (KR) | 2017-09-05 | — | — | US | disclosed |
| US-20150034914-A1 | ORGANIC COMPOUND AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE | CHEIL INDUSTRIES, INC. (KR) | 2015-02-05 | — | — | US | disclosed |