Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | EDNRA | P25101 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549274 | 0.96 | EDNRB (0.55) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8553017 | 0.91 | EDNRB (0.54) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8547962 | 0.89 | EDNRB (0.43) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8547512 | 0.89 | EDNRB (0.46) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8547644 | 0.88 | EDNRB (0.45) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8548161 | 0.88 | EDNRB (0.46) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8550986 | 0.87 | EDNRB (0.51) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8548022 | 0.86 | EDNRB (0.44) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8549630 | 0.86 | EDNRB (0.52) | EDNRBSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL8552494 | 0.85 | EDNRB (0.49) | EDNRBEDNRA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |