Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 5/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1774696 | 0.99 | PTGES2 (0.43) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| SCHEMBL1775494 | 0.94 | PTGES2 (0.42) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL1774599 | 0.93 | PTGES2 (0.42) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| SCHEMBL1775632 | 0.83 | CCR2 (0.45) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| SCHEMBL1775295 | 0.80 | CCR2 (0.44) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| SCHEMBL1777498 | 0.76 | HKDC1 (0.51) | ALDH1A1 | |
| SCHEMBL1776585 | 0.76 | HKDC1 (0.51) | ALDH1A1 | |
| SCHEMBL1774701 | 0.76 | HKDC1 (0.51) | ALDH1A1 | |
| SCHEMBL1379454 | 0.75 | MCOLN3 (0.58) | PTGES2ALDH1A1MCOLN3KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL1775351 | 0.75 | HKDC1 (0.50) | — |
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 |