Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.46 |
| ▸ | MC5R | P33032 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29349685 | 0.98 | CYP2A6 (0.60) | CYP2A6CYP1A2PTPN1HTR2AHTR2C | |
| SCHEMBL29707927 | 0.98 | CYP2A6 (0.60) | CYP2A6CYP1A2PTPN1HTR2AHTR2C | |
| SCHEMBL44621 | 0.98 | CYP2A6 (0.60) | CYP2A6CYP1A2PTPN1HTR2AHTR2C | |
| SCHEMBL6259103 | 0.95 | CYP2A6 (0.58) | CYP2A6CYP1A2PTPN1HTR2AHTR2C | |
| SCHEMBL11028429 | 0.95 | CYP2A6 (0.58) | CYP2A6CYP1A2PTPN1HTR2AHTR2C | |
| SCHEMBL5681757 | 0.91 | CYP2A6 (0.52) | CYP2A6CYP1A2HTR2AHTR2CHTR2B | |
| SCHEMBL27686121 | 0.91 | CYP2A6 (0.52) | CYP2A6CYP1A2HTR2AHTR2CHTR2B | |
| SCHEMBL14077417 | 0.89 | CYP1A2 (0.52) | CYP2A6CYP1A2HTR2AHTR2CHTR2B | |
| SCHEMBL1721014 | 0.87 | CYP1A2 (0.44) | CYP2A6CYP1A2HTR2AHTR2CHTR2B | |
| SCHEMBL29707612 | 0.87 | CYP1A2 (0.44) | CYP2A6CYP1A2HTR2AHTR2CHTR2B |
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-20200041901-A1 | SEMICONDUCTOR RESIST COMPOSITION, AND METHOD OF FORMING PATTERNS USING THE COMPOSITION | SAMSUNG SDI CO., LTD. (KR) | 2020-02-06 | — | — | US | disclosed |