Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL533711 | 0.94 | — | — | |
| Methyl Alcohol SCHEMBL9025055 | 0.92 | KMT2A (0.50) | KMT2AMEN1CYP1A2GAAMGAM | |
| Chloroform SCHEMBL8572106 | 0.90 | KMT2A (0.46) | KMT2AMEN1CYP1A2GAAMGAM | |
| Cyclohexane SCHEMBL3245595 | 0.88 | MEN1 (0.47) | KMT2AMEN1CYP1A2GAAMGAM | |
| Hexane SCHEMBL6533487 | 0.86 | DGKA (0.47) | KMT2AMEN1CYP1A2GAAMGAM | |
| SCHEMBL9311598 | 0.82 | CYP1A2 (0.55) | KMT2AMEN1CYP1A2GAAMGAM | |
| Ammonia Solution, Strong SCHEMBL27604884 | 0.80 | CYP1A2 (0.53) | KMT2AMEN1CYP1A2GAAMGAM | |
| SCHEMBL6670792 | 0.80 | CYP1A2 (0.53) | KMT2AMEN1CYP1A2GAAMGAM | |
| Toluene SCHEMBL6619389 | 0.79 | SMN1; SMN2 (0.48) | KMT2AMEN1ALDH1A1CYP4F2CYP4A11 | |
| SCHEMBL5395125 | 0.78 | GAA (0.52) | KMT2AMEN1CYP1A2GAAMGAM |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1298719-C | Purine derivatives, process for their preparation and pharmaceutical compositions containing them | EIWENTIS MEDICAMENT (FR) | 2007-02-07 | — | — | CN | disclosed |
| CN-1361780-A | Purine derivatives, preparation method and pharmaceutical compositions containing same | EIWENTIS MEDICAMENT (FR) | 2002-07-31 | — | — | CN | disclosed |
| EP-0709373-B1 | PYRROLIDINE DERIVATIVE | ZAIDAN HOJIN BISEIBUTSU (JP) | 2001-10-17 | — | — | EP | disclosed |
| US-5965556-A | KETO-ACID AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND METHODS FOR INHIBITING THE ACTIVITY OF SERINE PROTEASE OR THIOL PROTEASE BY ADMINISTERING THE DERIVATIVE TO A MAMMAL; ALZHEIMER'S DISEASE | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYUKAI (JP) | 1999-10-12 | — | — | US | disclosed |
| US-5756763-A | ENZYME INHIBITOR | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYUKAI (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0709373-A1 | NOVEL PYRROLIDINE DERIVATIVE | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1996-05-01 | — | — | EP | disclosed |
| US-4459290-A | ANTIBIOTICS | ELI LILLY AND COMPANY (US) | 1984-07-10 | — | — | US | disclosed |