Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24515867 | 0.87 | APP (0.48) | CFTRAPPKDM4ERECQLNOTUM | |
| SCHEMBL24983697 | 0.86 | CFTR (0.51) | CFTRKDM4EMAPTNOTUMLMNA | |
| SCHEMBL13027985 | 0.81 | KDM4E (0.58) | KDM4ERECQLMAPTLMNACYP3A4 | |
| SCHEMBL1763669 | 0.81 | APP (0.48) | CFTRAPPKDM4ERECQLNOTUM | |
| SCHEMBL2031824 | 0.79 | CFTR (0.60) | CFTRKDM4EMAPTNOTUMLMNA | |
| SCHEMBL3461530 | 0.79 | KDM4E (0.57) | KDM4ERECQLMAPTLMNACYP3A4 | |
| SCHEMBL23768065 | 0.79 | CFTR (0.48) | CFTRKDM4EMAPTNOTUMLMNA | |
| SCHEMBL8028301 | 0.79 | APP (0.39) | APPKDM4ERECQLMAPTLMNA | |
| SCHEMBL8037447 | 0.78 | S1PR1 (0.41) | APPKDM4EMAPTGAATMPRSS4 | |
| SCHEMBL23754415 | 0.77 | CFTR (0.61) | CFTRKDM4EMAPTNOTUMLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |