Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | PTGES | O14684 | 7/20 | 0.43 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1400577 | 0.85 | NPSR1 (0.50) | NPSR1PTGESALDH1A1LMNASMN1; SMN2 | |
| Benzene SCHEMBL11579847 | 0.85 | NPSR1 (0.50) | NPSR1PTGESALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL13305385 | 0.79 | PKM (0.54) | NPSR1PTGESALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11726572 | 0.79 | NPSR1 (0.46) | NPSR1ALDH1A1LMNASMN1; SMN2PKM | |
| SCHEMBL10869216 | 0.78 | PTGES (0.47) | NPSR1PTGESALDH1A1LMNATP53 | |
| SCHEMBL10793798 | 0.77 | MEN1 (0.45) | NPSR1PTGESALDH1A1MEN1KMT2A | |
| SCHEMBL10490445 | 0.77 | NPSR1 (0.45) | NPSR1ALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL6206534 | 0.76 | NPSR1 (0.48) | NPSR1ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL11570627 | 0.74 | ALDH1A1 (0.42) | NPSR1PTGESP2RX4ALDH1A1LMNA | |
| SCHEMBL11182796 | 0.74 | PKM (0.45) | NPSR1PTGESALDH1A1LMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102858767-B | As the aminopyrimidine of SYK inhibitor | MERCK SHARP & DOHME CORP. (US) | 2015-08-19 | — | — | CN | disclosed |