Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 4/20 | 0.37 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1438600 | 0.93 | HRH3 (0.43) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1439048 | 0.90 | HRH3 (0.41) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1438239 | 0.90 | HRH3 (0.45) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL15484527 | 0.87 | DRD3 (0.46) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1438485 | 0.86 | NPC1 (0.39) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1438821 | 0.85 | HRH3 (0.42) | HRH3KDM2BNPC1GAAHPGD | |
| SCHEMBL1437865 | 0.85 | PSEN1 (0.41) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1438554 | 0.84 | THRB (0.43) | HRH3GRIN1GRIN2BDRD3KDM2B | |
| SCHEMBL1438183 | 0.80 | DRD4 (0.40) | HRH3GRIN1GRIN2BSMPD1NPC1 | |
| SCHEMBL1438100 | 0.80 | EGFR (0.48) | GRIN1GRIN2BKDM2BFFAR1 |
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-2473490-A1 | (THIO)MORPHOLINE DERIVATIVES AS S1P MODULATORS | Abbott Healthcare Products B.V. (NL) | 2012-07-11 | — | — | EP | claimed |
| WO-2011023795-A1 | (THIO)MORPHOLINE DERIVATIVES AS S1P MODULATORS | ABBOTT HEALTHCARE PRODUCTS B.V. (NL) | 2011-03-03 | — | — | WO | claimed |