Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.45 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL103083 | 0.90 | HPGD (0.54) | KDM4EPKMMAPTTHRBHPGD | |
| Hydrochloric Acid SCHEMBL735395 | 0.88 | HPGD (0.53) | KDM4EPKMMAPTTHRBHPGD | |
| SCHEMBL17221591 | 0.84 | HPGD (0.56) | KDM4EPKMMAPTHPGDGPR119 | |
| SCHEMBL7819063 | 0.84 | MAPT (0.52) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL27669441 | 0.83 | USP2 (0.56) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL31028 | 0.83 | USP2 (0.56) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL8152888 | 0.82 | MAPT (0.50) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL4508565 | 0.82 | GPR119 (0.48) | KDM4EPKMMAPTTHRBGPR119 | |
| Ammonia Solution, Strong SCHEMBL27841683 | 0.82 | USP2 (0.55) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL8993970 | 0.82 | HPGD (0.47) | KDM4EPKMMAPTTHRBHPGD |
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-1644356-A1 | SUBSTITUTED 4-AMINO-1-BENZYLPIPERIDINE COMPOUNDS | Theravance, Inc. (US) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005007645-A1 | SUBSTITUTED 4-AMINO-1-BENZYLPIPERIDINE COMPOUNDS | THERAVANCE, INC. (US) | 2005-01-27 | — | — | WO | disclosed |