Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.42 |
| ▸ | MGLL | Q99685 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.41 |
| ▸ | ATXN2 | Q99700 | 2/20 | 0.41 |
| ▸ | F13A1 | P00488 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.40 |
| ▸ | TGM1 | P22735 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL543599 | 0.88 | MGLL (0.43) | NPSR1PTGDR2MGLLMEN1KMT2A | |
| SCHEMBL543597 | 0.84 | ENPP2 (0.52) | NPSR1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL542951 | 0.83 | ENPP2 (0.54) | NPSR1PTGDR2MEN1KMT2AENPP2 | |
| SCHEMBL542959 | 0.83 | HPGD (0.43) | NPSR1PTGDR2MEN1KMT2AENPP2 | |
| SCHEMBL16825237 | 0.81 | ENPP2 (0.54) | NPSR1PTGDR2MEN1KMT2AMAPK1 | |
| SCHEMBL543033 | 0.79 | HPGD (0.47) | NPSR1SMN1; SMN2PTGDR2MEN1KMT2A | |
| SCHEMBL543231 | 0.79 | MEN1 (0.55) | NPSR1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL511398 | 0.79 | GAA (0.53) | SMN1; SMN2PTGDR2KMT2AALDH1A1 | |
| SCHEMBL11226918 | 0.78 | IDO1 (0.46) | NPSR1SMN1; SMN2PTGDR2MGLLMEN1 | |
| SCHEMBL351769 | 0.78 | PTGDR2 (0.46) | PTGDR2MGLLENPP2ATXN2ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2414330-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | Merck Patent GmbH (DE) | 2012-02-08 | — | — | EP | claimed |
| WO-2010115491-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | MERCK PATENT GMBH (DE) | 2010-10-14 | — | — | WO | claimed |
| EP-2414330-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | Merck Patent GmbH (DE) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010115491-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | MERCK PATENT GMBH (DE) | 2010-10-14 | — | — | WO | disclosed |