Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.37 |
| ▸ | GLO1 | Q04760 | 3/20 | 0.37 |
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GPR39 | O43194 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16320203 | 0.77 | ALDH1A1 (0.48) | LMNAALDH1A1GAAMAPK1 | |
| SCHEMBL16319954 | 0.74 | PTGS2 (0.48) | MAPK1 | |
| SCHEMBL5609641 | 0.71 | GLO1 (0.50) | GRM4GLO1SLC40A1KDM4ECYP17A1 | |
| SCHEMBL5610166 | 0.70 | GLO1 (0.49) | GLO1SLC40A1KDM4EL3MBTL1 | |
| SCHEMBL8164647 | 0.67 | GLO1 (0.55) | GRM4ALDH1A1GLO1SLC40A1KDM4E | |
| SCHEMBL16320125 | 0.67 | PKM (0.45) | LMNAALDH1A1KDM4EHSD17B10MEN1 | |
| SCHEMBL25391392 | 0.65 | GLO1 (0.47) | GLO1SLC40A1CYP17A1L3MBTL1 | |
| SCHEMBL19512927 | 0.65 | HPGD (0.51) | LMNAALDH1A1GLO1SLC40A1GAA | |
| SCHEMBL5609697 | 0.65 | GLO1 (0.47) | GRM4GLO1SLC40A1KDM4ECYP17A1 | |
| SCHEMBL8515156 | 0.65 | PFKFB3 (0.65) | ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2544684-B1 | 4,4-DISUBSTITUTED PIPERIDINE DERIVATIVES USEFUL AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-1 (DPP-1) | JANSSEN PHARMACEUTICA NV (BE) | 2014-12-24 | — | — | EP | disclosed |