Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 2/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 10/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1855979 | 1.00 | PLK1 (0.57) | PLK1TRPV1KDM4EPLK3NR1H4 | |
| SCHEMBL5043915 | 0.85 | PLK1 (0.60) | PLK1TRPV1KDM4EPLK3NR1H4 | |
| SCHEMBL1856443 | 0.85 | PLK1 (0.60) | PLK1TRPV1KDM4EPLK3NR1H4 | |
| SCHEMBL5039945 | 0.84 | PLK1 (0.59) | PLK1TRPV1KDM4EPLK3NPC1 | |
| SCHEMBL5043914 | 0.84 | PLK1 (0.59) | PLK1TRPV1KDM4EPLK3NPC1 | |
| SCHEMBL1850742 | 0.83 | FAAH (0.46) | PLK1TRPV1KDM4EPTGS1 | |
| SCHEMBL1858706 | 0.83 | PLK1 (0.57) | PLK1TRPV1KDM4EPLK3NR1H4 | |
| SCHEMBL1855980 | 0.83 | PLK1 (0.57) | PLK1TRPV1KDM4EPLK3NR1H4 | |
| SCHEMBL6718414 | 0.82 | MLYCD (0.60) | PLK1 | |
| SCHEMBL1854194 | 0.81 | PLK1 (0.58) | PLK1TRPV1KDM4EPLK3NR1H4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1470102-B1 | SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) | MERCK SERONO SA (CH) | 2011-05-25 | — | — | EP | disclosed |
| EP-1470102-A1 | SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) | Applied Research Systems ARS Holding N.V. (AN) | 2004-10-27 | — | — | EP | disclosed |
| WO-2003064376-A1 | SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) | APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) | 2003-08-07 | — | — | WO | disclosed |