Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL6008493 | 1.00 | UGT2B7 (0.52) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL7436041 | 1.00 | UGT2B7 (0.52) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL11624148 | 0.85 | UGT2B7 (0.48) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL15345330 | 0.82 | SLC2A1 (0.46) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL31036013 | 0.82 | SLC2A1 (0.46) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL11631139 | 0.82 | SLC6A2 (0.54) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| Hydrochloric Acid SCHEMBL28703571 | 0.80 | SLC6A2 (0.56) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL1661660 | 0.80 | UGT2B7 (0.52) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL4335674 | 0.80 | UGT2B7 (0.52) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL29463570 | 0.80 | UGT2B7 (0.52) | UGT2B7SLC6A4SLC6A2SLC6A3CYP2D6 |
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-6187905-B1 | PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES | HOFFMANN-LA ROCHE INC. | 2001-02-13 | — | — | US | disclosed |