Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | GOT1 | P17174 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | MPO | P05164 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.49 |
| ▸ | ACOX1 | Q15067 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 3/20 | 0.47 |
| ▸ | KDR | P35968 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29617978 | 1.00 | ALDH1A1 (0.49) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL14993997 | 0.85 | ALDH1A1 (0.47) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL354115 | 0.83 | EGFR (0.53) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL27930312 | 0.83 | ALDH1A1 (0.46) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL29684247 | 0.83 | EGFR (0.53) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL9584154 | 0.83 | EGFR (0.50) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL7374802 | 0.83 | ILK (0.42) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL260660 | 0.81 | KDM4E (0.53) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL463374 | 0.80 | EGFR (0.47) | ALDH1A1RAB9AKDM4ELMNANPC1 | |
| SCHEMBL28279906 | 0.79 | EGFR (0.49) | ALDH1A1RAB9AKDM4ELMNANPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101410387-B | Pyridyl-and pyrimidinyl-substituted pyrrole-, thiophene-and furan-derivatives as kinase inhibitors | NERVIANO MEDICAL SCIENCES SRL | 2013-12-18 | — | — | CN | disclosed |
| CN-1249026-C | N-guanidinoalkylamides, their preparation, their use, and pharmaceutical preparations containing them | AVENTIS PHARMA GMBH (DE) | 2006-04-05 | — | — | CN | disclosed |
| CN-1387508-A | N-guanidinoalkylamides, their preparation, their use, and pharmaceutical preparations comprising them | AVENTIS PHARMA GMBH (DE) | 2002-12-25 | — | — | CN | disclosed |
| US-5082842-A | Sedatives | HOFFMANN-LA ROCHE INC. (US) | 1992-01-21 | — | — | US | disclosed |
| EP-0226196-A2 | Tricyclic pyridone derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1987-06-24 | — | — | EP | disclosed |