Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.57 |
| ▸ | FDPS | P14324 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.53 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.53 |
| ▸ | ABAT | P80404 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29955595 | 0.86 | ALDH1A1 (0.61) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL13819488 | 0.86 | ALDH1A1 (0.61) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL16930085 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL347664 | 0.84 | FDPS (0.45) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL2432443 | 0.82 | ALDH1A1 (0.66) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL29957052 | 0.82 | ALDH1A1 (0.66) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL2967999 | 0.81 | ALDH1A1 (0.51) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL7344641 | 0.81 | ALDH1A1 (0.54) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL9505345 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL4769506 | 0.80 | ALDH1A1 (0.53) | ALDH1A1TSHRAOX1FDPSHPGD |
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-1149069-A1 | PHENYLGLYCINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-10-31 | — | — | EP | disclosed |
| WO-2000035858-A1 | PHENYLGLYCINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-06-22 | — | — | WO | disclosed |