Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.58 |
| ▸ | PPARD | Q03181 | 1/20 | 0.58 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.58 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP12 | P39900 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.49 |
| ▸ | CTSG | P08311 | 2/20 | 0.49 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.49 |
| ▸ | CMA1 | P23946 | 2/20 | 0.49 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2871593 | 1.00 | LCK (0.58) | LCKPPARDZDHHC20ZDHHC2CES2 | |
| SCHEMBL1248513 | 0.98 | LCK (0.55) | LCKPPARDZDHHC20ZDHHC2CES2 | |
| SCHEMBL648332 | 0.93 | CES2 (0.47) | LCKPPARDZDHHC20ZDHHC2CES2 | |
| SCHEMBL4935875 | 0.86 | SLC6A2 (0.53) | CES2CES1PRSS1CTSGCTRB1 | |
| SCHEMBL2823791 | 0.86 | SLC6A2 (0.53) | CES2CES1PRSS1CTSGCTRB1 | |
| SCHEMBL10965524 | 0.84 | MMP2 (0.55) | LCKPPARDZDHHC20ZDHHC2MMP2 | |
| SCHEMBL10833561 | 0.84 | MMP2 (0.55) | LCKPPARDZDHHC20ZDHHC2MMP2 | |
| SCHEMBL30979218 | 0.83 | CES2 (0.53) | CES2CES1MMP2MMP9MMP12 | |
| SCHEMBL29117316 | 0.83 | MMP2 (0.63) | CES2CES1MMP2MMP9MMP12 | |
| SCHEMBL27836181 | 0.83 | CES2 (0.53) | CES2CES1MMP2MMP9MMP12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4054719-A | ACRYLIC ESTER, TERTIARY AMINE | AMERICAN CYANAMID COMPANY (US) | 1977-10-18 | — | — | US | disclosed |