Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 5/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.36 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.36 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4078616 | 0.95 | EGLN1 (0.41) | ALDH1A1KMT2AKDM4EHPGDLMNA | |
| SCHEMBL4075081 | 0.87 | DHODH (0.44) | ALDH1A1KDM4EHPGDLMNAEGLN1 | |
| SCHEMBL1033757 | 0.82 | SCN9A (0.35) | ALDH1A1KDM4EHPGDLMNAGAA | |
| SCHEMBL4078497 | 0.82 | ESR1 (0.38) | ALDH1A1KMT2AKDM4EHPGDLMNA | |
| SCHEMBL1033120 | 0.82 | SMN1; SMN2 (0.47) | ALDH1A1EGLN1THRATHRBPRKAB2 | |
| SCHEMBL522422 | 0.82 | EGLN1 (0.45) | ALDH1A1KMT2AKDM4EHPGDLMNA | |
| SCHEMBL4069669 | 0.82 | DHODH (0.44) | ALDH1A1KDM4EHPGDLMNAEGLN1 | |
| SCHEMBL4074682 | 0.81 | DHODH (0.39) | ALDH1A1KMT2AGAAMEN1TP53 | |
| SCHEMBL1034732 | 0.81 | NPC1 (0.38) | EGLN1THRATHRBNPC1RAB9A | |
| SCHEMBL1031021 | 0.80 | NPC1 (0.38) | ALDH1A1KDM4EHPGDLMNAEGLN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1538160-B1 | Substituted Isoquinolin-3-carboxyamides, their preparation and medical use | FIBROGEN INC (US) | 2009-06-03 | — | — | EP | disclosed |