Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.57 |
| ▸ | HTR2B | P41595 | 2/20 | 0.49 |
| ▸ | HTR5A | P47898 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | GPR3 | P46089 | 1/20 | 0.48 |
| ▸ | CDK4 | P11802 | 2/20 | 0.47 |
| ▸ | CCND1 | P24385 | 2/20 | 0.47 |
| ▸ | TOP2A | P11388 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | KIF11 | P52732 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20306691 | 0.90 | CDK4 (0.52) | AHRHTR2BHTR5AALDH1A1HSD17B10 | |
| SCHEMBL15055126 | 0.85 | AHR (0.77) | AHRALDH1A1HSD17B10GPR3TOP2A | |
| SCHEMBL15073657 | 0.85 | AHR (0.77) | AHRALDH1A1HSD17B10GPR3TOP2A | |
| SCHEMBL31450477 | 0.84 | HTR2B (0.57) | AHRHTR2BHTR5AALDH1A1HSD17B10 | |
| SCHEMBL21709342 | 0.84 | TNKS2 (0.53) | AHRCDK4CCND1ESR1ESR2 | |
| SCHEMBL23155062 | 0.84 | CDK4 (0.54) | AHRALDH1A1HSD17B10CDK4CCND1 | |
| SCHEMBL16310851 | 0.84 | AHR (0.63) | AHRHTR2BHTR5AALDH1A1HSD17B10 | |
| SCHEMBL22678744 | 0.84 | KIF11 (0.64) | AHRHTR2BHTR5AALDH1A1HSD17B10 | |
| SCHEMBL29965589 | 0.83 | AHR (0.68) | AHRALDH1A1HSD17B10GPR3TOP2A | |
| SCHEMBL30600017 | 0.83 | AHR (0.68) | AHRALDH1A1HSD17B10GPR3TOP2A |
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-2021230651-A1 | ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2021-11-18 | — | — | WO | disclosed |