Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1F | P30939 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6926769 | 0.77 | CREBBP (0.34) | CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL13496703 | 0.75 | HTR5A (0.36) | CHRNB2CHRNB4CHRNA3CHRNA4CYP1A2 | |
| SCHEMBL29070701 | 0.74 | HTR2C (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4HTR1A | |
| SCHEMBL30570960 | 0.74 | HTR2C (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4HTR1A | |
| SCHEMBL27437424 | 0.73 | TDP1 (0.35) | CHRNB2CHRNA4CYP1A2MAPTKMT2A | |
| SCHEMBL28115423 | 0.73 | PARP1 (0.36) | CYP1A2MAPTCYP2C19KMT2AHTR1D | |
| SCHEMBL27740237 | 0.73 | CMA1 (0.34) | CYP1A2CYP2C19KMT2A | |
| SCHEMBL28997205 | 0.73 | ALDH1A1 (0.34) | CYP1A2MAPTKMT2A | |
| Methylamine SCHEMBL27568812 | 0.72 | BRD4 (0.35) | CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL28114067 | 0.72 | ESR1 (0.36) | CYP1A2MAPTCYP2C19KMT2AHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116462636-A | Synthesis method of 3-alkyl quinoxaline-2 (1H) ketone compound mediated by visible light | 河南师范大学 | 2023-07-21 | — | — | CN | disclosed |