Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.46 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 2/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | CTSS | P25774 | 8/20 | 0.39 |
| ▸ | CTSK | P43235 | 7/20 | 0.39 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.37 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL584547 | 0.91 | SCN9A (0.49) | MTNR1AMTNR1BKLK5TACR1SCN9A | |
| SCHEMBL584495 | 0.90 | SCN9A (0.47) | MTNR1AMTNR1BSCN9ACTSSCTSK | |
| SCHEMBL17061439 | 0.89 | MTNR1A (0.46) | MTNR1AMTNR1BKLK5TACR1SCN9A | |
| SCHEMBL17071630 | 0.87 | KLK5 (0.43) | KLK5TACR1SCN9ACTSSCTSK | |
| SCHEMBL12035787 | 0.86 | MTNR1A (0.46) | MTNR1AMTNR1BKLK5TACR1SCN9A | |
| SCHEMBL4651817 | 0.84 | KLK5 (0.41) | KLK5TACR1SCN9ACTSSCTSK | |
| SCHEMBL12035495 | 0.83 | KLK5 (0.46) | MTNR1AMTNR1BKLK5TACR1SCN9A | |
| SCHEMBL15701998 | 0.83 | KLK5 (0.46) | MTNR1AMTNR1BKLK5TACR1SCN9A | |
| SCHEMBL17101171 | 0.80 | MTNR1A (0.51) | MTNR1AMTNR1BTACR1SCN9ACTSS | |
| SCHEMBL18833348 | 0.80 | MTNR1A (0.51) | MTNR1AMTNR1BTACR1SCN9ACTSS |
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 |
|---|---|---|---|---|---|---|---|
| US-9024093-B2 | Fluorination of organic compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2015-05-05 | — | — | US | disclosed |
| WO-2010059943-A2 | FLUORINATION OF ORGANIC COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2010-05-27 | — | — | WO | disclosed |