Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | RARG | P13631 | 2/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL22202733 | 0.98 | SIGMAR1 (0.38) | SIGMAR1RARGRARBCHRNB2CHRNA4 | |
| SCHEMBL22202447 | 0.94 | GABRA1 (0.35) | SIGMAR1KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22202296 | 0.92 | SIGMAR1 (0.37) | SIGMAR1RARGRARBKDM4EALDH1A1 | |
| SCHEMBL22202755 | 0.92 | GABRA1 (0.35) | SIGMAR1KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22202448 | 0.89 | TNK2 (0.36) | SIGMAR1GABRA1GABRB2 | |
| SCHEMBL22202724 | 0.88 | TNK2 (0.36) | SIGMAR1GABRA1GABRB2 | |
| SCHEMBL22202507 | 0.87 | ALDH1A1 (0.39) | RARGRARBCHRNB2CHRNA4KDM4E | |
| SCHEMBL22202558 | 0.86 | SIGMAR1 (0.33) | SIGMAR1KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22202298 | 0.85 | ALDH1A1 (0.38) | SIGMAR1KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22202725 | 0.85 | SIGMAR1 (0.39) | SIGMAR1RARGRARBCHRNB2CHRNA4 |
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-20200216605-A1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2020-07-09 | — | — | US | disclosed |