Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 5/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.35 |
| ▸ | USP7 | Q93009 | 2/20 | 0.34 |
| ▸ | USP10 | Q14694 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8209422 | 0.93 | DRD2 (0.37) | F10TMEM97SIGMAR1DRD2DRD3 | |
| SCHEMBL8206710 | 0.91 | TMEM97 (0.39) | F10TMEM97SIGMAR1DRD2DRD3 | |
| SCHEMBL8205988 | 0.90 | ACVR1 (0.43) | F10ACVR1S1PR1LCKJAK3 | |
| SCHEMBL8205845 | 0.90 | HDAC1 (0.41) | TMEM97SIGMAR1DRD2DRD3USP7 | |
| SCHEMBL8206008 | 0.90 | TMEM97 (0.38) | F10TMEM97SIGMAR1DRD2DRD3 | |
| SCHEMBL8203793 | 0.89 | ACVR1 (0.35) | F10DRD2DRD3ACVR1 | |
| SCHEMBL8209425 | 0.89 | S1PR1 (0.35) | F10DRD2DRD3ACVR1S1PR1 | |
| SCHEMBL8203780 | 0.88 | SIGMAR1 (0.44) | TMEM97SIGMAR1DRD2DRD3USP7 | |
| SCHEMBL8193482 | 0.88 | ITK (0.41) | ACVR1LCKJAK3 | |
| SCHEMBL8198832 | 0.87 | HDAC6 (0.43) | DRD2DRD3ACVR1LCKJAK3 |
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-2008052934-A1 | NOVEL SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2008-05-08 | — | — | WO | disclosed |