Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3290324 | 0.80 | MEN1 (0.68) | TSHRSIGMAR1FAAHMEN1KMT2A | |
| SCHEMBL8552266 | 0.80 | ALDH1A1 (0.63) | ALDH1A1TSHRATMRECQLL3MBTL1 | |
| Hydrochloric Acid SCHEMBL7828669 | 0.78 | MEN1 (0.66) | TSHRSIGMAR1FAAHMEN1KMT2A | |
| SCHEMBL1474753 | 0.78 | SIGMAR1 (0.70) | TSHRATMSIGMAR1MEN1KMT2A | |
| SCHEMBL14456744 | 0.77 | KMT2A (0.56) | ALDH1A1TSHRKDM4ELMNAMEN1 | |
| SCHEMBL28542706 | 0.76 | ALDH1A1 (0.58) | ALDH1A1TSHRATMRECQLL3MBTL1 | |
| SCHEMBL8228144 | 0.75 | KMT2A (0.54) | ALDH1A1TSHRATMKDM4ELMNA | |
| SCHEMBL3747521 | 0.75 | FAAH (0.68) | ALDH1A1TSHRATMRECQLL3MBTL1 | |
| SCHEMBL5016390 | 0.75 | MEN1 (0.65) | ALDH1A1TSHRKDM4EFAAHHPGD | |
| SCHEMBL8550475 | 0.74 | ALDH1A1 (0.59) | ALDH1A1TSHRATMRECQLL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1084329-C | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 2002-05-08 | — | — | CN | disclosed |
| EP-0871613-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-21 | — | — | EP | disclosed |
| US-5753679-A | SCIZOPHRENIA | HOFFMANN-LA ROCHE INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1996035666-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 1996-11-14 | — | — | WO | disclosed |