Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 7/20 | 0.46 |
| ▸ | HTR2B | P41595 | 7/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 4/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.43 |
| ▸ | SQSTM1 | Q13501 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1776585 | 1.00 | HKDC1 (0.51) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| SCHEMBL1774701 | 1.00 | HKDC1 (0.51) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL1775808 | 0.99 | HKDC1 (0.50) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL1775345 | 0.99 | HKDC1 (0.50) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL1775351 | 0.99 | HKDC1 (0.50) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| SCHEMBL1775005 | 0.94 | HKDC1 (0.49) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL1776019 | 0.93 | HKDC1 (0.48) | HKDC1HTR2CHTR2BKEAP1NFE2L2 | |
| SCHEMBL1775785 | 0.88 | KEAP1 (0.61) | HKDC1KEAP1NFE2L2SQSTM1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1773873 | 0.87 | KEAP1 (0.60) | HKDC1KEAP1NFE2L2SQSTM1ALDH1A1 | |
| SCHEMBL1775494 | 0.82 | PTGES2 (0.42) | HTR2CHTR2BALDH1A1 |
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-7943639-B2 | Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss | PROXIMAGEN LIMITED (GB) | 2011-05-17 | — | — | US | claimed |