Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | PPARA | Q07869 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PAM | P19021 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.39 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | LAP3 | P28838 | 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 | |
|---|---|---|---|---|
| SCHEMBL6182569 | 0.85 | CYP1A2 (0.47) | PPARGPPARACYP1A2SRRALPI | |
| SCHEMBL9313447 | 0.80 | TSHR (0.57) | CYP1A2PAMKMT2ASRR | |
| SCHEMBL9303074 | 0.79 | ELANE (0.46) | CYP19A1KMT2APRSS1PRSS2PRSS3 | |
| SCHEMBL9303071 | 0.79 | ELANE (0.46) | CYP19A1KMT2APRSS1PRSS2PRSS3 | |
| SCHEMBL9303346 | 0.78 | KDM4E (0.40) | PPARGPPARAKMT2APRSS1PRSS2 | |
| SCHEMBL9305059 | 0.78 | ALDH1A1 (0.50) | CYP19A1KMT2APRSS1PRSS2PRSS3 | |
| SCHEMBL9305068 | 0.78 | ALDH1A1 (0.50) | CYP19A1KMT2APRSS1PRSS2PRSS3 | |
| SCHEMBL28102449 | 0.77 | PAM (0.68) | CYP19A1PAMKMT2A | |
| SCHEMBL28238266 | 0.77 | ELANE (0.51) | CYP19A1KMT2APRSS1PRSS2PRSS3 | |
| SCHEMBL4219709 | 0.76 | ALDH1A1 (0.55) | CYP1A2KMT2ASRRLTA4HLAP3 |
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 |