Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 6/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL519964 | 0.94 | SMN1; SMN2 (0.50) | SMN1; SMN2MAPTMEN1KMT2APKM | |
| SCHEMBL519468 | 0.82 | ALDH1A1 (0.52) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| SCHEMBL2060081 | 0.77 | ALDH1A1 (0.51) | SMN1; SMN2MEN1KMT2AALOX12ALDH1A1 | |
| SCHEMBL13088685 | 0.77 | ALDH1A1 (0.49) | SMN1; SMN2MEN1KMT2AALOX12ALDH1A1 | |
| SCHEMBL29943719 | 0.77 | EPHX1 (0.50) | SMN1; SMN2MEN1KMT2AALOX12ALDH1A1 | |
| SCHEMBL520337 | 0.76 | TSHR (0.48) | SMN1; SMN2MAPTLMNAALDH1A1CYP1A2 | |
| SCHEMBL25327014 | 0.76 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTMEN1KMT2APKM | |
| SCHEMBL15971741 | 0.75 | SMN1; SMN2 (0.50) | SMN1; SMN2MAPTMEN1KMT2APKM | |
| SCHEMBL19888167 | 0.74 | ALDH1A1 (0.51) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| SCHEMBL12395228 | 0.71 | F10 (0.40) | SMN1; SMN2MAPTLMNAALDH1A1CYP1A2 |
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-2022194261-A1 | PYRIMIDINE-FUSED CYCLIC COMPOUND AND USE THEREOF IN PREPARATION OF DRUG FOR TREATING PAIN AND SPINAL CORD INJURY | 南京药石科技股份有限公司 | 2022-09-22 | — | — | WO | disclosed |