Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 9/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8415002 | 0.80 | MAPT (0.54) | MAPTPOLBS1PR2AKR1B1PTGDR2 | |
| SCHEMBL10533803 | 0.77 | MAPT (0.71) | MAPTPOLBS1PR2AKR1B1KMT2A | |
| SCHEMBL1969701 | 0.76 | ELANE (0.49) | KMT2AKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL28325749 | 0.76 | MAPT (0.50) | MAPTPOLBS1PR2AKR1B1PTGDR2 | |
| Oxalic Acid SCHEMBL28043151 | 0.74 | ELANE (0.40) | POLBKMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL22061004 | 0.74 | MAPT (0.55) | MAPTPOLBS1PR2AKR1B1PTGDR2 | |
| SCHEMBL9321303 | 0.71 | PTGER4 (0.59) | S1PR2AKR1B1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4433081 | 0.70 | KDM4E (0.50) | EGFRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL29178113 | 0.70 | MAPT (0.50) | MAPTPOLBAKR1B1PTGDR2KMT2A | |
| SCHEMBL19585733 | 0.70 | SMN1; SMN2 (0.53) | MAPTKMT2AEGFRKDM4EALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0682009-B1 | Intermediate compounds for preparing endothelin-receptor antagonist triterpene derivatives | SHIONOGI & CO (JP) | 1998-05-06 | — | — | EP | disclosed |
| US-5587505-A | Triterpene derivatives and endothelin-receptor antagonists containing the same | SHIONOGI & CO., LTD. (JP) | 1996-12-24 | — | — | US | disclosed |
| EP-0628569-B1 | Triterpene derivatives and endothelin-receptor antagonists containing the same | SHIONOGI & CO (JP) | 1996-09-11 | — | — | EP | disclosed |
| EP-0682009-A2 | Intermediate compounds for preparing endothelin-receptor antagonist triterpene derivatives | SHIONOGI & CO., LTD. (JP) | 1995-11-15 | — | — | EP | disclosed |
| US-5463107-A | Useful in prophylaxis and treatment of diseases caused by excessive secretion of endothelin | SHIONOGI & CO., LTD. (JP) | 1995-10-31 | — | — | US | disclosed |
| EP-0628569-A1 | Triterpene derivatives and endothelin-receptor antagonists containing the same | SHIONOGI & CO., LTD. (JP) | 1994-12-14 | — | — | EP | disclosed |