Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.38 |
| ▸ | FABP3 | P05413 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7370266 | 0.80 | SMN1; SMN2 (0.44) | TSHRMAPTALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL7374874 | 0.80 | SMN1; SMN2 (0.41) | NR1H4MAPTALDH1A1FABP3FABP4 | |
| SCHEMBL7406142 | 0.76 | GRIA1 (0.58) | CYP1A2CYP2C19SMN1; SMN2KDM4EHPGD | |
| SCHEMBL7406133 | 0.76 | GRIA1 (0.58) | CYP1A2CYP2C19SMN1; SMN2KDM4EHPGD | |
| SCHEMBL7367693 | 0.76 | KDM4E (0.43) | TSHRMAPTALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL7373678 | 0.74 | NPC1 (0.43) | NR1H4ALDH1A1GLASMN1; SMN2KDM4E | |
| SCHEMBL8120933 | 0.73 | GRIN2D (0.39) | MAPTALDH1A1CYP1A2CYP2C19MCL1 | |
| SCHEMBL7374568 | 0.71 | MAPT (0.50) | TSHRMAPK1MAPTALDH1A1BRCA1 | |
| SCHEMBL8120929 | 0.69 | MCL1 (0.36) | TSHRMAPTALDH1A1FABP3FABP4 | |
| SCHEMBL7406301 | 0.65 | GRIA1 (0.44) | MCL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0994107-A1 | 5-Arylisoxazol-4-yl-substituted 2-amino carboxylic acid compounds | H. LUNDBECK A/S (DK) | 2000-04-19 | — | — | EP | disclosed |
| EP-0726896-A1 | 5-ARYLISOXAZOL-4-YL-SUBSTITUTED 2-AMINO CARBOXYLIC ACID COMPOUNDS | H. LUNDBECK A/S (DK) | 1996-08-21 | — | — | EP | disclosed |
| WO-1995012587-A1 | 5-ARYLISOXAZOL-4-YL-SUBSTITUTED 2-AMINO CARBOXYLIC ACID COMPOUNDS | H. LUNDBECK A/S (DK) | 1995-05-11 | — | — | WO | disclosed |