Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.56 |
| ▸ | CTSK | P43235 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8334464 | 0.91 | CTSS (0.56) | CTSSCTSKALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL8348046 | 0.89 | CTSS (0.54) | CTSSCTSKSMN1; SMN2MAPTS1PR3 | |
| SCHEMBL8348878 | 0.89 | CTSS (0.54) | CTSSCTSKALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL8337352 | 0.88 | CTSS (0.60) | CTSSCTSKALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL8348009 | 0.88 | CTSS (0.60) | CTSSCTSKALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL6824801 | 0.85 | BRD4 (0.60) | BRD4ALDH1A1KMT2ASMN1; SMN2MAPT | |
| SCHEMBL8336332 | 0.83 | CTSS (0.60) | CTSSCTSKALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL8336972 | 0.82 | CTSS (0.57) | CTSSCTSKALDH1A1MAPTTP53 | |
| SCHEMBL8336805 | 0.82 | CTSS (0.57) | CTSSCTSKKMT2AMAPTTHRB | |
| SCHEMBL8337969 | 0.82 | CTSS (0.57) | CTSSCTSKALDH1A1KMT2AMAPT |
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-2004022534-A1 | ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |