Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8709051 | 0.92 | MAPT (0.39) | MAPTEGFRERBB2ITGB3ITGAV | |
| SCHEMBL8705645 | 0.90 | MEN1 (0.41) | MAPTPPARANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8706237 | 0.89 | ITGB3 (0.40) | MAPTITGB3ITGAVNPC1RAB9A | |
| SCHEMBL8709447 | 0.88 | ITGB3 (0.48) | MAPTEGFRERBB2ITGB3ITGAV | |
| SCHEMBL8709683 | 0.87 | ITGB3 (0.43) | MAPTEGFRERBB2ITGB3ITGAV | |
| SCHEMBL8709876 | 0.86 | BCL2 (0.42) | MAPTEGFRERBB2ITGB3ITGAV | |
| SCHEMBL8706016 | 0.85 | NPC1 (0.44) | MAPTITGB3ITGAVNPC1RAB9A | |
| SCHEMBL8712032 | 0.84 | SLC7A5 (0.43) | MAPTITGB3ITGAVSMN1; SMN2MEN1 | |
| SCHEMBL8709691 | 0.84 | ITGB3 (0.39) | MAPTEGFRERBB2ITGB3ITGAV | |
| SCHEMBL8712259 | 0.84 | BMP1 (0.43) | MAPTEGFRERBB2PPARANPC1 |
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-1998041515-A1 | ENDOTHOLIN RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 1998-09-24 | — | — | WO | disclosed |