Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BMP1 | P13497 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 5/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | 0.93 | MAPT (0.39) | BMP1EGFRERBB2NPC1RAB9A | |
| SCHEMBL8709961 | 0.91 | ITGB3 (0.36) | BMP1EGFRERBB2RAB9AMAPT | |
| SCHEMBL8709556 | 0.91 | MEN1 (0.43) | EGFRERBB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8706016 | 0.90 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2MEN1GAA | |
| SCHEMBL6320795 | 0.90 | EDNRA (0.39) | NPC1RAB9ACA9POLBAKR1C3 | |
| SCHEMBL8710009 | 0.90 | GAA (0.41) | EGFRERBB2RAB9AGAAMAPT | |
| SCHEMBL8711325 | 0.90 | EGFR (0.40) | EGFRERBB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6322172 | 0.88 | TDP1 (0.40) | SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL8705562 | 0.87 | EDNRA (0.40) | MEN1KMT2A | |
| SCHEMBL8708878 | 0.87 | LARS1 (0.43) | GAAMAPT |
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 |