Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | S100A4 | P26447 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TDP2 | O95551 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | NOS1 | P29475 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5259225 | 0.86 | CAPN9 (0.54) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL4426047 | 0.71 | TGM2 (0.38) | CA9CA1CA2CA7KDM4E | |
| SCHEMBL11812939 | 0.71 | PTPRC (0.62) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL4142069 | 0.71 | PTPRC (0.62) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL1163249 | 0.70 | PTPRC (0.52) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL31376381 | 0.70 | CASP3 (0.75) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL2521332 | 0.70 | CASP3 (0.75) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL5608905 | 0.69 | ALDH1A1 (0.46) | CYP3A4TDP1ALDH1A1MEN1KMT2A | |
| SCHEMBL17950757 | 0.69 | CYP3A4 (0.54) | PTPRCCYP3A4S100A4TDP1CAPN9 | |
| SCHEMBL3172442 | 0.68 | PTPRC (0.53) | PTPRCCYP3A4S100A4TDP1CAPN9 |
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-2004037814-A1 | INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-05-06 | — | — | WO | disclosed |