Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6438339 | 0.99 | FFAR1 (0.45) | FFAR1FFAR4ALDH1A1NPC1TP53 | |
| Hydrochloric Acid SCHEMBL6438603 | 0.86 | LMNA (0.47) | FFAR1FFAR4ALDH1A1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL6437878 | 0.86 | KMT2A (0.44) | FFAR1FFAR4ALDH1A1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL6438082 | 0.84 | LMNA (0.52) | FFAR1FFAR4LMNAHPGDTSHR | |
| SCHEMBL5535678 | 0.84 | MAOB (0.56) | FFAR1FFAR4ALDH1A1NPC1TP53 | |
| Hydrochloric Acid SCHEMBL6438092 | 0.83 | FFAR1 (0.43) | FFAR1FFAR4ALDH1A1NPC1TP53 | |
| SCHEMBL3364915 | 0.79 | MAOB (0.56) | ALDH1A1NPC1TP53GLAPKM | |
| SCHEMBL3893136 | 0.74 | CHRNA7 (0.51) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL791963 | 0.73 | ALDH1A1 (0.54) | ALDH1A1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL24196349 | 0.73 | MAPT (0.56) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 |
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-1542971-A1 | 4-PYRROLIDINO-PHENYL-BENZYL ETHER DERIVATIVES | F. Hoffmann-La Roche Ltd. (CH) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004026826-A1 | 4-PYRROLIDINO-PHENYL-BENZYL ETHER DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-04-01 | — | — | WO | disclosed |