Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 12/20 | 1.00 |
| ▸ | CYP19A1 | P11511 | 11/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | PRKCA | P17252 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8898120 | 1.00 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL8898126 | 1.00 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL8897307 | 0.84 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AMEN1 | |
| SCHEMBL8899923 | 0.84 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AMEN1 | |
| SCHEMBL8897312 | 0.84 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AMEN1 | |
| SCHEMBL8068078 | 0.74 | CYP17A1 (0.59) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL8080716 | 0.74 | CYP17A1 (0.59) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL8068085 | 0.74 | CYP17A1 (0.59) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL16731832 | 0.72 | CYP17A1 (0.55) | CYP17A1CYP19A1KMT2AALDH1A1PRKCA | |
| SCHEMBL8067904 | 0.71 | CYP17A1 (1.00) | CYP17A1CYP19A1KMT2AALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5595995-A | ANTICARCINOGENIC AGENTS | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1997-01-21 | — | — | US | disclosed |
| WO-1993023375-A1 | SUBSTITUTED PYRIDINES, THEIR PREPARATION AND PHARMACEUTICAL USE | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1993-11-25 | — | — | WO | disclosed |