Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 5/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23355338 | 0.90 | KDM4E (0.38) | KDM4EKMT2ACA1CA2CA9 | |
| SCHEMBL23355389 | 0.87 | KDM4E (0.36) | KDM4EKMT2ACA1CA2CA9 | |
| SCHEMBL23355422 | 0.80 | ADORA1 (0.34) | KDM4EKMT2ATP53SMN1; SMN2MAPT | |
| SCHEMBL23355413 | 0.78 | LRRK2 (0.40) | KDM4ETP53SMN1; SMN2NPC1RAB9A | |
| SCHEMBL23368182 | 0.78 | EGFR (0.47) | — | |
| SCHEMBL23368158 | 0.77 | KDM4E (0.45) | KDM4EKMT2ATP53SMN1; SMN2NPC1 | |
| SCHEMBL23355355 | 0.70 | LRRK2 (0.32) | — | |
| SCHEMBL15877172 | 0.70 | SLC2A1 (0.43) | KDM4EKMT2ATP53NPC1MAPT | |
| Trifluoroacetic Acid SCHEMBL23355453 | 0.70 | SMN1; SMN2 (0.39) | KDM4EKMT2ATP53SMN1; SMN2NPC1 | |
| SCHEMBL23355331 | 0.69 | MAPT (0.40) | KDM4EKMT2ACA1CA2CA9 |
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-3822263-A1 | BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2021-05-19 | — | — | EP | disclosed |