Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAM | P19021 | 1/20 | 0.45 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 3/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CTSC | P53634 | 1/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29279724 | 0.81 | MMP1 (0.49) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL4872068 | 0.79 | GRIK1 (0.57) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL4872085 | 0.79 | GRIK1 (0.57) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL4872078 | 0.79 | GRIK1 (0.57) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL4872094 | 0.79 | GRIK1 (0.57) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL9640412 | 0.78 | CYP1A2 (0.46) | PAMLMNAMAOBAKR1B10AKR1B1 | |
| SCHEMBL9054488 | 0.74 | CYP1A2 (0.44) | — | |
| SCHEMBL251039 | 0.74 | PAM (0.59) | PAMLMNAMAOBMMP1MMP2 | |
| SCHEMBL27989732 | 0.73 | GRIK1 (0.62) | PAMGRIK1GRIK2HTR2ALMNA | |
| SCHEMBL27689553 | 0.73 | GRIK1 (0.62) | PAMGRIK1GRIK2HTR2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-106834250-B | Esterase EstK1 protein and application thereof | 中国海洋大学 | 2020-04-28 | — | — | CN | disclosed |
| CN-106834250-A | A kind of esterase EstK1 albumen and its application | 中国海洋大学 | 2017-06-13 | — | — | CN | disclosed |