Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.46 |
| ▸ | RAB9A | P51151 | 8/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 8/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4463774 | 1.00 | ALDH1A1 (0.46) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL4473452 | 0.86 | CA9 (0.52) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL6230240 | 0.86 | CA9 (0.52) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL4462968 | 0.79 | HPGD (0.40) | ALDH1A1KDM4EHPGD | |
| SCHEMBL6254603 | 0.77 | RAB9A (0.59) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL4471054 | 0.77 | RAB9A (0.59) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL5535855 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL4468796 | 0.76 | KDM4E (0.42) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL4463139 | 0.76 | MEN1 (0.60) | ALDH1A1RAB9AKDM4EHPGDMEN1 | |
| SCHEMBL13143053 | 0.76 | CASP1 (0.53) | ALDH1A1RAB9AKDM4EHPGDMEN1 |
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-1528923-A1 | N-((3-OXO-2,3-DIHYDRO-1H-ISOINDOL-1-YL)ACETYL)GUANIDINE DERIVATIVES AS NHE1-INHIBITORS FOR THE TREATMENT OF INFARCTION AND ANGINA PECTORIS | Aventis Pharma Deutschland GmbH (DE) | 2005-05-11 | — | — | EP | disclosed |
| WO-2003101450-A1 | N- ((3-OXO2, 3-DIHYDRO-1H-ISOINDOL-1-YL) ACETYL) GUANIDINE DERIVATIVES AS NHE-1 INHIBITORS FOR THE TREATMENT OF INFARCTION AND ANGINA PECTORIS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2003-12-11 | — | — | WO | disclosed |