Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 3/20 | 0.43 |
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8036853 | 0.90 | SIRT2 (0.54) | ALDH1A1ADORA3TSHRHSD17B10USP2 | |
| SCHEMBL8032162 | 0.81 | SIRT2 (0.52) | ALDH1A1TSHRHSD17B10USP2MAPK1 | |
| SCHEMBL4017101 | 0.80 | TSHR (0.43) | ALDH1A1KDM4EHPGDGAATSHR | |
| SCHEMBL8762855 | 0.78 | HSD17B10 (0.52) | ALDH1A1KDM4EHPGDGAAADORA3 | |
| SCHEMBL8026733 | 0.77 | SIRT2 (0.56) | ALDH1A1KDM4EHPGDGAATSHR | |
| SCHEMBL7216561 | 0.75 | ADORA3 (0.60) | ALDH1A1KDM4EHPGDGAAADORA3 | |
| SCHEMBL22712554 | 0.75 | USP2 (0.48) | ALDH1A1KDM4EHPGDGAAADORA3 | |
| SCHEMBL8022429 | 0.73 | SIRT2 (0.52) | ALDH1A1TSHRHSD17B10USP2MAPK1 | |
| SCHEMBL8040651 | 0.73 | ADORA3 (0.47) | ALDH1A1KDM4EHPGDGAAADORA3 | |
| SCHEMBL22712539 | 0.72 | HSD17B10 (0.46) | ALDH1A1KDM4EHPGDGAAADORA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009080242-A1 | SUBSTITUTED 4-AMINOPYRIMIDINE-5-CARBOXYLIC ACID AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-07-02 | — | — | WO | disclosed |