Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2092050 | 0.81 | PIM1 (0.49) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL13790221 | 0.81 | CYP2D6 (0.50) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL254957 | 0.80 | MAPT (0.56) | PIM1PIM2MAPTEPHX2KDM4E | |
| SCHEMBL15117409 | 0.79 | PIM1 (0.47) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL28757636 | 0.77 | MAPT (0.47) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL97114 | 0.77 | ALDH1A1 (0.52) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL2116917 | 0.77 | PIM1 (0.46) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL171790 | 0.77 | ALDH1A1 (0.50) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL3396974 | 0.77 | PIM1 (0.46) | PIM1PIM2MAPTEPHX2CYP2D6 | |
| SCHEMBL1047423 | 0.77 | PIM1 (0.46) | PIM1PIM2MAPTEPHX2CYP2D6 |
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 |