Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | FNTA | P49354 | 1/20 | 0.34 |
| ▸ | FNTB | P49356 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6160403 | 0.99 | KCNH3 (0.36) | CDK9KCNH3HTR1ADRD2HTR2A | |
| SCHEMBL7823470 | 0.92 | DRD2 (0.35) | CDK9KCNH3HTR1ADRD2HTR2A | |
| Hydrochloric Acid SCHEMBL6157964 | 0.91 | KCNH3 (0.36) | CDK9KCNH3HTR1ADRD2HTR2A | |
| SCHEMBL7823784 | 0.90 | KMT2A (0.37) | KCNH3MEN1MAPTMAPK1KMT2A | |
| Hydrochloric Acid SCHEMBL6157868 | 0.89 | KMT2A (0.36) | KCNH3MEN1MAPTMAPK1KMT2A | |
| SCHEMBL6158484 | 0.88 | KDM4E (0.35) | KCNH3ALDH1A1SCN9ANPC1RAB9A | |
| SCHEMBL6995590 | 0.87 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AMEN1MAPT | |
| SCHEMBL6990113 | 0.87 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AMEN1MAPT | |
| SCHEMBL6996524 | 0.87 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AMEN1MAPT | |
| Hydrochloric Acid SCHEMBL6161078 | 0.87 | KDM4E (0.37) | KCNH3ALDH1A1SCN9ANPC1RAB9A |
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-1131312-A1 | NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION, LTD. (KR) | 2001-09-12 | — | — | EP | disclosed |
| WO-2000029403-A1 | NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2000-05-25 | — | — | WO | disclosed |