Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAT1 | P18440 | 3/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
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 SCHEMBL1647973 | 0.85 | NAT1 (0.36) | NAT1PTGES2ALOX5APMCL1HSD17B10 | |
| SCHEMBL14725678 | 0.85 | NAT1 (0.36) | NAT1PTGES2ALOX5APMCL1HSD17B10 | |
| Hydrochloric Acid SCHEMBL1648354 | 0.79 | NAT1 (0.33) | NAT1HSD17B10TSHRSMN1; SMN2MAPT | |
| SCHEMBL18784244 | 0.77 | CSNK2A1 (0.40) | NAT1PTGES2ALOX5APALDH1A1HSD17B10 | |
| SCHEMBL18784224 | 0.77 | ALOX5AP (0.37) | NAT1PTGES2ALOX5APMCL1ALDH1A1 | |
| SCHEMBL1648374 | 0.72 | METAP2 (0.40) | NAT1PTGES2ALOX5APMCL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1648037 | 0.72 | NAT1 (0.34) | NAT1PTGES2ALOX5APMCL1ALDH1A1 | |
| SCHEMBL14725681 | 0.71 | NAT1 (0.35) | NAT1PTGES2ALOX5APMCL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1648362 | 0.71 | METAP2 (0.39) | NAT1ALOX5APMCL1HSD17B10TSHR | |
| Hydrochloric Acid SCHEMBL1648336 | 0.71 | METAP2 (0.39) | NAT1ALOX5APMCL1HSD17B10TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2486004-B1 | SULPHONE COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY | ZAFGEN INC (US) | 2017-05-03 | — | — | EP | claimed |