Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PHGDH | O43175 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8103317 | 1.00 | TSHR (0.41) | TSHRPHGDHHPGDSMN1; SMN2GAA | |
| Iodide SCHEMBL5949586 | 0.99 | SMN1; SMN2 (0.41) | TSHRPHGDHHPGDSMN1; SMN2GAA | |
| Iodide SCHEMBL5949583 | 0.99 | SMN1; SMN2 (0.41) | TSHRPHGDHHPGDSMN1; SMN2GAA | |
| SCHEMBL6344962 | 0.91 | PHGDH (0.38) | TSHRPHGDHHPGDSMN1; SMN2GAA | |
| SCHEMBL8103467 | 0.87 | ACHE (0.42) | TSHRHPGDSMN1; SMN2GAAACHE | |
| SCHEMBL8103469 | 0.87 | ACHE (0.42) | TSHRHPGDSMN1; SMN2GAAACHE | |
| Iodide SCHEMBL5948720 | 0.86 | KDM4E (0.44) | TSHRHPGDSMN1; SMN2GAAACHE | |
| Iodide SCHEMBL5948723 | 0.86 | KDM4E (0.44) | TSHRHPGDSMN1; SMN2GAAACHE | |
| SCHEMBL8103390 | 0.79 | MAPT (0.38) | TSHRPHGDHHPGDSMN1; SMN2GAA | |
| SCHEMBL8103388 | 0.79 | MAPT (0.38) | TSHRPHGDHHPGDSMN1; SMN2GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1050531-A1 | Pyridine and piperidine derivatives for treating neurodegenerative diseases | ADIR ET COMPAGNIE (FR) | 2000-11-08 | — | — | EP | disclosed |