Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | MPI | P34949 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1269540 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2KMT2AKDM4EL3MBTL1 | |
| SCHEMBL4162744 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| SCHEMBL29756221 | 0.82 | NPSR1 (0.48) | ALDH1A1KMT2AKDM4EL3MBTL1HSD17B10 | |
| SCHEMBL13406205 | 0.82 | KDM4E (0.50) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| SCHEMBL267964 | 0.82 | NPSR1 (0.48) | ALDH1A1KMT2AKDM4EL3MBTL1HSD17B10 | |
| SCHEMBL8309273 | 0.81 | KDM4E (0.49) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| SCHEMBL26172461 | 0.79 | TARBP2 (0.48) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| SCHEMBL19609345 | 0.79 | ALDH1A1 (0.45) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| Hydrochloric Acid SCHEMBL19583715 | 0.78 | ALDH1A1 (0.44) | ALDH1A1CYP1A2KMT2AKDM4EMAPK1 | |
| SCHEMBL1680317 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CYP1A2KMT2AKDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105085429-A | Heteroaromatic derivative and application thereof to medicament | GUANGDONG HEC PHARMACEUTICAL | 2015-11-25 | — | — | CN | disclosed |