Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.37 |
| ▸ | HPGD | P15428 | 7/20 | 0.37 |
| ▸ | NPC1 | O15118 | 6/20 | 0.37 |
| ▸ | RAB9A | P51151 | 6/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5763248 | 0.75 | HPGD (0.43) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL13484387 | 0.74 | FAAH (0.43) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL8291559 | 0.74 | FAAH (0.38) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL13484009 | 0.70 | ALDH1A1 (0.46) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL12262584 | 0.69 | CYP2C19 (0.48) | ALDH1A1RAB9ASMN1; SMN2CYP2C19MEN1 | |
| SCHEMBL12262043 | 0.69 | CYP2C19 (0.48) | ALDH1A1RAB9ASMN1; SMN2CYP2C19MEN1 | |
| SCHEMBL1425381 | 0.69 | CYP2C19 (0.48) | ALDH1A1RAB9ASMN1; SMN2CYP2C19MEN1 | |
| Hydrochloric Acid SCHEMBL5807316 | 0.69 | FAAH (0.48) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL26616404 | 0.69 | FAAH (0.60) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL10626253 | 0.68 | ALDH1A1 (0.69) | KDM4EALDH1A1HPGDNPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1682524-A1 | NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS | Aventis Pharmaceuticals, Inc. (US) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005040142-A9 | NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS | AVENTIS PHARMA INC (US) | 2005-06-09 | — | — | WO | disclosed |
| WO-2005040142-A1 | NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2005-05-06 | — | — | WO | disclosed |