Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28545499 | 0.81 | ALDH1A1 (0.41) | ALDH1A1RAB9AMAPTKMT2ALMNA | |
| SCHEMBL28537207 | 0.81 | ALDH1A1 (0.39) | ALDH1A1RAB9ASLC6A3KDM4EMAPT | |
| SCHEMBL28910725 | 0.80 | CYP19A1 (0.43) | ALDH1A1SLC6A3MAPTKMT2ACYP19A1 | |
| SCHEMBL28542552 | 0.80 | MDM2 (0.40) | ALDH1A1SLC6A3MAPTGAATSHR | |
| SCHEMBL31650964 | 0.79 | ALDH1A1 (0.56) | ALDH1A1CA2RAB9ASLC6A3KDM4E | |
| SCHEMBL28911292 | 0.78 | POLB (0.37) | ALDH1A1KDM4EMAPTPOLBSMN1; SMN2 | |
| SCHEMBL28545946 | 0.78 | MEN1 (0.38) | ALDH1A1KDM4EMAPTPOLBKMT2A | |
| SCHEMBL983728 | 0.77 | ALDH1A1 (0.54) | ALDH1A1CA2RAB9ASLC6A3KDM4E | |
| SCHEMBL28452557 | 0.77 | ALDH1A1 (0.54) | ALDH1A1CA2RAB9ASLC6A3KDM4E | |
| SCHEMBL28541784 | 0.76 | MGLL (0.35) | ALDH1A1RAB9ASLC6A3MAPTKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5326887-A | Reacting ester of alpha hydroxy acid oligomer over fixed bed catalyst | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-07-05 | — | — | US | disclosed |
| WO-1992015572-A1 | PROCESS FOR THE PREPARATION OF 1,4-DIOXANE-2,5-DIONES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-09-17 | — | — | WO | disclosed |