Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL418265 | 0.86 | KDM4E (0.55) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL421391 | 0.84 | NPC1 (0.53) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL14944865 | 0.79 | DYRK1A (0.46) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL5871324 | 0.79 | NPC1 (0.49) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| Hydrochloric Acid SCHEMBL20562963 | 0.78 | DYRK1A (0.45) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL20563305 | 0.77 | NPC1 (0.51) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL4943705 | 0.76 | DYRK1A (0.44) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL360535 | 0.76 | NPC1 (0.46) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL414036 | 0.76 | NPC1 (0.58) | NPC1RAB9ATDP1KDM4EHKDC1 | |
| SCHEMBL5871480 | 0.76 | NPC1 (0.45) | NPC1RAB9ATDP1KDM4EHKDC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103209968-A | Pluripotent stem cell cardiomyocyte differentiation-promoting agent | UNIV KYOTO | 2013-07-17 | — | — | CN | disclosed |
| EP-2408769-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | Glaxo Group Limited (GB) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010106016-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | GLAXO GROUP LIMITED (GB) | 2010-09-23 | — | — | WO | disclosed |