Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6632048 | 0.81 | ADORA2A (0.36) | ALDH1A1KDM4EGAAKMT2ALMNA | |
| SCHEMBL31133143 | 0.77 | NPSR1 (0.43) | NPSR1ALDH1A1KDM4EGAATP53 | |
| SCHEMBL7004410 | 0.75 | NPSR1 (0.41) | NPSR1ALDH1A1KDM4EGAATP53 | |
| Iodomethane SCHEMBL3389060 | 0.74 | MEN1 (0.40) | NPSR1ALDH1A1GAAPOLBKMT2A | |
| SCHEMBL18878421 | 0.70 | NPSR1 (0.39) | NPSR1ALDH1A1KDM4EGAATP53 | |
| SCHEMBL22659694 | 0.68 | NPSR1 (0.45) | NPSR1ALDH1A1KDM4EGAATP53 | |
| SCHEMBL6996899 | 0.68 | NPSR1 (0.36) | NPSR1ALDH1A1KDM4EGAATP53 | |
| SCHEMBL7792914 | 0.68 | ALDH1A1 (0.57) | NPSR1ALDH1A1KDM4EGAATP53 | |
| SCHEMBL21621672 | 0.67 | NPSR1 (0.43) | NPSR1ALDH1A1KDM4EGAAPOLB | |
| SCHEMBL21637130 | 0.66 | — | — |
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-2010043633-A1 | 2H-PYRAZOLO [4,3-D]PYRIMIDIN-5-AMINE DERIVATIVES AS H4 HISTAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF ALLERGIC, IMMUNOLOGICAL AND INFLAMMATORY DISEASES | PALAU PHARMA, S. A. (ES) | 2010-04-22 | — | — | WO | disclosed |