Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | CTSL | P07711 | 4/20 | 0.44 |
| ▸ | CTSB | P07858 | 4/20 | 0.44 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28138491 | 0.75 | HTT (0.65) | HTTKMT2ACYP2C9CYP3A4CYP2C19 | |
| SCHEMBL2399935 | 0.72 | HTT (0.96) | HTTKMT2ACYP2C9CYP3A4CYP2C19 | |
| SCHEMBL28639115 | 0.72 | HTT (0.59) | HTTCTSLCTSBCTSKMEN1 | |
| N-Piperidinobenzamide SCHEMBL696161 | 0.71 | HTT (1.00) | HTTKMT2ACYP2C9SMN1; SMN2LMNA | |
| SCHEMBL9282775 | 0.71 | HTT (1.00) | HTTKMT2ACYP2C9SMN1; SMN2LMNA | |
| SCHEMBL7449374 | 0.71 | CCR3 (0.60) | HTTMEN1KMT2A | |
| SCHEMBL4630363 | 0.70 | GNAI3 (0.37) | HTTMEN1KMT2ASMN1; SMN2GAA | |
| SCHEMBL7716857 | 0.68 | HTT (0.69) | HTTCYP2C9CYP3A4CYP2C19SMN1; SMN2 | |
| SCHEMBL1576773 | 0.68 | CYP2D6 (0.71) | HTTKMT2ACYP2C9CYP3A4CYP2C19 | |
| SCHEMBL717372 | 0.68 | HTT (0.69) | HTTCYP2C9CYP3A4CYP2C19SMN1; SMN2 |
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-1919907-A2 | HETEROCYCLIC COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026959-A2 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-03-08 | — | — | WO | disclosed |