Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.34 |
| ▸ | PDE5A | O76074 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL23308280 | 0.98 | ABCG2 (0.33) | ABCG2PDE5AHSD17B10MAPK1CYP1A2 | |
| SCHEMBL23308249 | 0.97 | ABCG2 (0.32) | ABCG2PDE5AHSD17B10MAPK1CYP1A2 | |
| SCHEMBL23308213 | 0.96 | ABCG2 (0.31) | ABCG2PDE5ACRHR1METAP2 | |
| SCHEMBL23308235 | 0.94 | CRHR1 (0.32) | ABCG2CRHR1 | |
| SCHEMBL23308310 | 0.94 | ABCG2 (0.32) | ABCG2PDE5AHSD17B10MAPK1CYP1A2 | |
| SCHEMBL23308325 | 0.94 | TSPO (0.36) | ABCG2PDE5A | |
| SCHEMBL23308237 | 0.94 | METAP2 (0.33) | ABCG2PDE5AMETAP2 | |
| SCHEMBL23308279 | 0.93 | DUSP3 (0.32) | ABCG2PDE5ACRHR1 | |
| SCHEMBL23308304 | 0.92 | ABCG2 (0.31) | ABCG2PDE5ACRHR1 | |
| SCHEMBL23308294 | 0.92 | DUSP3 (0.32) | ABCG2PDE5A |
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 |
|---|---|---|---|---|---|---|---|
| US-20210126204-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE | SAMSUNG SDI CO., LTD. (KR) | 2021-04-29 | — | — | US | disclosed |