Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28958473 | 0.87 | TSHR (0.43) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL30198325 | 0.84 | RECQL (0.62) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL5709879 | 0.84 | CYP3A4 (0.64) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL5420738 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL5420740 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL28958330 | 0.83 | CYP3A4 (0.51) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL28246238 | 0.81 | CYP3A4 (0.74) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL17816196 | 0.81 | CYP3A4 (0.64) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL1232706 | 0.80 | CYP3A4 (0.58) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL19754046 | 0.80 | TSHR (0.68) | CYP3A4TSHRTDP1ATMRECQL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109843848-B | Method for producing hydroxyalkyl carboxylic acid esters | 巴斯夫欧洲公司 | 2023-02-28 | — | — | CN | disclosed |