Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.45 |
| ▸ | HRH1 | P35367 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | CXCR1 | P25024 | 2/20 | 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 SCHEMBL4743260 | 0.99 | EPHX1 (0.49) | EPHX1HRH3HRH1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4747673 | 0.99 | EPHX1 (0.49) | EPHX1HRH3HRH1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4423787 | 0.98 | EPHX1 (0.50) | EPHX1HRH3HRH1MEN1KMT2A | |
| SCHEMBL14798227 | 0.87 | EPHX1 (0.49) | EPHX1ALOX5PTGS1PTGS2TSHR | |
| SCHEMBL13254979 | 0.87 | TSHR (0.52) | EPHX1MEN1KMT2AALOX5PTGS1 | |
| Hydrochloric Acid SCHEMBL4916216 | 0.86 | TSHR (0.51) | EPHX1MEN1KMT2AALOX5PTGS1 | |
| Hydrochloric Acid SCHEMBL28474995 | 0.78 | PTGS1 (0.55) | MEN1KMT2AALOX5PTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL4910410 | 0.77 | EPHX1 (0.56) | EPHX1ALOX5PTGS1PTGS2TSHR | |
| Hydrochloric Acid SCHEMBL4747052 | 0.76 | EPHX1 (0.51) | EPHX1MEN1KMT2AALOX5PTGS1 | |
| Hydrochloric Acid SCHEMBL4745587 | 0.76 | EPHX1 (0.51) | EPHX1MEN1KMT2AALOX5PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008110351-A2 | USE OF (R) AND (S)-2-ARYL-PROPIONIC ACID DERIVATIVES AS ANTISEPTIC AGENTS | DOMPE' PHA.R.MA S.P.A. (IT) | 2008-09-18 | — | — | WO | disclosed |