Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9305068 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KMT2ALMNAMAPK1ATM | |
| SCHEMBL5690338 | 0.82 | ATM (0.58) | ALDH1A1KMT2ALMNAMAPK1ATM | |
| SCHEMBL11119110 | 0.82 | ATM (0.58) | ALDH1A1KMT2ALMNAMAPK1ATM | |
| SCHEMBL2246434 | 0.82 | ATM (0.58) | ALDH1A1KMT2ALMNAMAPK1ATM | |
| SCHEMBL9303074 | 0.81 | ELANE (0.46) | ALDH1A1KMT2ALMNAATML3MBTL1 | |
| SCHEMBL9303071 | 0.81 | ELANE (0.46) | ALDH1A1KMT2ALMNAATML3MBTL1 | |
| SCHEMBL28238266 | 0.79 | ELANE (0.51) | ALDH1A1KMT2ALMNAATML3MBTL1 | |
| SCHEMBL9312069 | 0.79 | TSHR (0.51) | ALDH1A1KMT2ALMNAMAPK1CES2 | |
| SCHEMBL9304130 | 0.78 | CYP19A1 (0.43) | KMT2ACYP19A1PRSS1PRSS2PRSS3 | |
| SCHEMBL15726613 | 0.77 | PRSS1 (0.49) | ALDH1A1KMT2ALMNAATML3MBTL1 |
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 |