Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | F13A1 | P00488 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | TGM1 | P22735 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 5/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 5/20 | 0.36 |
| ▸ | ATXN2 | Q99700 | 3/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL542687 | 0.86 | EPHX2 (0.45) | EPHX2PTGDR2F13A1TGM2TGM1 | |
| SCHEMBL543314 | 0.84 | ENPP2 (0.41) | PTGDR2F13A1TGM2TGM1DPP4 | |
| SCHEMBL543034 | 0.82 | TACR1 (0.47) | HTR2AENPP2ATXN2TACR1 | |
| SCHEMBL542993 | 0.81 | MGLL (0.43) | EPHX2PTGDR2F13A1TGM2TGM1 | |
| SCHEMBL543241 | 0.79 | MEN1 (0.42) | PTGDR2F13A1TGM2TGM1PARP1 | |
| SCHEMBL4678059 | 0.79 | DPP4 (0.55) | PTGDR2DPP4PARP1MEN1KMT2A | |
| SCHEMBL543599 | 0.78 | MGLL (0.43) | PTGDR2F13A1TGM2TGM1PARP1 | |
| Hydrochloric Acid SCHEMBL4680856 | 0.78 | DPP4 (0.54) | PTGDR2DPP4PARP1MEN1KMT2A | |
| SCHEMBL542992 | 0.78 | F13A1 (0.37) | EPHX2PTGDR2F13A1TGM2TGM1 | |
| SCHEMBL543046 | 0.77 | ENPP2 (0.51) | EPHX2PTGDR2DPP4PARP1CACNA1H |
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 |
|---|---|---|---|---|---|---|---|
| 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 |