Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | PTPRA | P18433 | 1/20 | 0.51 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.51 |
| ▸ | HRH1 | P35367 | 2/20 | 0.50 |
| ▸ | NOS1 | P29475 | 3/20 | 0.49 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.45 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.45 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.45 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.45 |
| ▸ | ARG1 | P05089 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL28078250 | 1.00 | CYP1A2 (0.55) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL28102642 | 0.94 | HRH1 (0.55) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL28102643 | 0.94 | HRH1 (0.55) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL30428132 | 0.90 | SLC1A5 (0.56) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL1768948 | 0.90 | SLC1A5 (0.56) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL1176394 | 0.90 | SLC1A5 (0.56) | CYP1A2CYP2C19SMN1; SMN2PTPRASLC1A5 | |
| SCHEMBL27734507 | 0.88 | CYP1A2 (0.51) | CYP1A2CYP2C19SMN1; SMN2PTPRAHRH1 | |
| SCHEMBL27734504 | 0.88 | CYP1A2 (0.51) | CYP1A2CYP2C19SMN1; SMN2PTPRAHRH1 | |
| Ornithine Aketoglutarate SCHEMBL3838101 | 0.82 | PTPRA (0.54) | CYP1A2PTPRASLC1A5HRH1GRIN2D | |
| Ornithine SCHEMBL3838093 | 0.82 | PTPRA (0.54) | CYP1A2PTPRASLC1A5HRH1GRIN2D |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107636007-A | Beta hairpin peptide mimics | 波利弗尔股份公司 | 2018-01-26 | — | — | CN | disclosed |
| CN-107001426-A | Beta-hairpin peptidomimetics | 波利弗尔股份公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-107001425-A | Beta hairpin peptide mimics | 波利弗尔股份公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-102844327-B | Template-fixed peptidomimetics with CXCR7 modulatory activity | 波利弗尔股份公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-105849119-A | Beta-hairpin peptidomimetics | 波利弗尔股份公司 | 2016-08-10 | — | — | CN | disclosed |
| CN-105324390-A | Beta-hairpin peptidomimetics | POLYPHOR AG | 2016-02-10 | — | — | CN | disclosed |