Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.34 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | ADH1B | P00325 | 2/20 | 0.33 |
| ▸ | ADH1C | P00326 | 2/20 | 0.33 |
| ▸ | ADH1A | P07327 | 2/20 | 0.33 |
| ▸ | ADH7 | P40394 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ADH4 | P08319 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19774502 | 0.96 | TSHR (0.44) | TSHRALDH1A1DNM1CYP3A4ACE2 | |
| SCHEMBL4317793 | 0.95 | TSHR (0.46) | TSHRALDH1A1DNM1CYP3A4ACE2 | |
| SCHEMBL22854544 | 0.91 | ACE2 (0.47) | TSHRALDH1A1DNM1ACE2LMNA | |
| SCHEMBL22701029 | 0.91 | ACE2 (0.47) | TSHRALDH1A1DNM1ACE2LMNA | |
| SCHEMBL24673884 | 0.91 | ACE2 (0.47) | TSHRALDH1A1DNM1ACE2LMNA | |
| SCHEMBL14547173 | 0.88 | ALDH1A1 (0.41) | TSHRALDH1A1DNM1CYP3A4ACE2 | |
| SCHEMBL10596435 | 0.86 | CA12 (0.43) | TSHRALDH1A1DNM1CYP3A4ACE2 | |
| SCHEMBL7109086 | 0.86 | TSHR (0.52) | TSHRALDH1A1DNM1CYP3A4ACE2 | |
| SCHEMBL18388567 | 0.85 | TSHR (0.42) | TSHRALDH1A1PAOXADH1BADH1A | |
| SCHEMBL8125049 | 0.85 | TSHR (0.42) | TSHRALDH1A1PAOXADH1BADH1A |
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-2336136-A1 | Pyridine derivatives and their use in the treatment of psychotic disorders | GlaxoSmithKline LLC (US) | 2011-06-22 | — | — | EP | disclosed |
| WO-2007028654-A1 | PYRIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHOTIC DISORDERS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-03-15 | — | — | WO | disclosed |