Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | RBP4 | P02753 | 1/20 | 0.39 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4733366 | 0.84 | MALT1 (0.46) | SCDSMN1; SMN2DRD2DRD3MALT1 | |
| SCHEMBL4729979 | 0.81 | MALT1 (0.48) | HTTSMN1; SMN2DRD2DRD3MALT1 | |
| SCHEMBL5096292 | 0.81 | ALDH1A1 (0.47) | HTTDRD2DRD3CYP3A4MAPT | |
| SCHEMBL4731861 | 0.80 | SCD (0.45) | SCDHTTSMN1; SMN2TRPV1DRD2 | |
| SCHEMBL4728680 | 0.79 | GRM4 (0.46) | SMN1; SMN2DRD2DRD3MALT1MAPT | |
| SCHEMBL4730521 | 0.79 | SCD (0.58) | SCDHTTSMN1; SMN2DRD2DRD3 | |
| SCHEMBL5094275 | 0.79 | SLC6A7 (0.44) | SCDMALT1CCNCCDK8MEN1 | |
| SCHEMBL4732425 | 0.78 | FPR2 (0.49) | SCDHTTSMN1; SMN2DRD2DRD3 | |
| SCHEMBL4733745 | 0.72 | KDM4E (0.48) | SMN1; SMN2MALT1 | |
| SCHEMBL5102640 | 0.70 | MALT1 (0.49) | SMN1; SMN2MALT1MAPTMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008058064-A1 | AMINE-LINKED MULTICYCLIC COMPOUNDS AS INHIBITORS OF THE PROLINE TRANSPORTER | LEXICON PHARMACEUTICALS, INC. (US) | 2008-05-15 | — | — | WO | disclosed |