Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.51 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.49 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.49 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.48 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.48 |
| ▸ | PIP4K2B | P78356 | 1/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.48 |
| ▸ | ATR | Q13535 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6985231 | 0.91 | NPC1 (0.55) | NPC1RAB9APIK3CAPIK3CGCYP11B1 | |
| SCHEMBL6986226 | 0.85 | FLT3 (0.47) | NPC1RAB9AKMT2AMEN1BRAF | |
| SCHEMBL6978131 | 0.85 | MEN1 (0.51) | NPC1RAB9APIK3CAPIK3CGCYP11B1 | |
| SCHEMBL6985848 | 0.82 | DYRK1A (0.50) | PIK3CAPIK3CGCYP11B1CYP11B2CYP17A1 | |
| SCHEMBL11222723 | 0.82 | CNR1 (0.64) | NPC1RAB9APIK3CAPIK3CGCYP11B1 | |
| SCHEMBL6986460 | 0.81 | MKNK1 (0.46) | NPC1RAB9APIK3CAPIK3CGCYP11B1 | |
| SCHEMBL6985095 | 0.79 | CYP11B1 (0.45) | NPC1RAB9APIK3CACYP11B1CYP11B2 | |
| SCHEMBL6981139 | 0.78 | CYP3A4 (0.54) | NPC1RAB9APIK3CAPIK3CGCYP11B1 | |
| SCHEMBL14384819 | 0.78 | PKM (0.55) | NPC1RAB9AHSD17B1HSD17B2KMT2A | |
| Hydrochloric Acid SCHEMBL6985047 | 0.78 | CYP11B1 (0.44) | NPC1RAB9APIK3CACYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1283209-A1 | NOVEL BENZOTHIOPHENE DERIVATIVES | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2003-02-12 | — | — | EP | disclosed |