Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | F9 | P00740 | 2/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | MAP3K8 | P41279 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CDC25B | P30305 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17383290 | 0.96 | HDAC1 (0.40) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL19801867 | 0.93 | ALDH1A1 (0.49) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383291 | 0.91 | HDAC1 (0.40) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383275 | 0.91 | HDAC1 (0.36) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383309 | 0.90 | ALDH1A1 (0.42) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383296 | 0.90 | ALDH1A1 (0.42) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL19151982 | 0.90 | HDAC1 (0.38) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17382700 | 0.88 | ALDH1A1 (0.39) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383151 | 0.88 | ALDH1A1 (0.39) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL17383305 | 0.87 | ALDH1A1 (0.40) | HDAC1ALDH1A1CYP3A4HPGDHSD17B10 |
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-2017123008-A1 | ORGANIC LIGHT-EMITTING DEVICE, ORGANIC LIGHT-EMITTING DISPLAY DEVICE, AND COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE | 덕산네오룩스 주식회사 | 2017-07-20 | — | — | WO | disclosed |