Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 6/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 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 | |
|---|---|---|---|---|
| SCHEMBL25045148 | 0.78 | NOTUM (0.51) | NOTUMESRRA | |
| SCHEMBL12443625 | 0.74 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL11942620 | 0.73 | CYP19A1 (0.56) | NOTUMGRM5 | |
| SCHEMBL4855602 | 0.71 | CYP2C9 (0.47) | L3MBTL1TSHRGRM5NPC1RAB9A | |
| SCHEMBL16090354 | 0.69 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL2629357 | 0.69 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL12959177 | 0.69 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL23028378 | 0.69 | NOTUM (0.58) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL541468 | 0.69 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 | |
| SCHEMBL2889068 | 0.69 | P2RX7 (0.55) | NOTUMP2RX7MAOAL3MBTL1DRD2 |
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-118126046-A | Substituted macrocyclic compound, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-06-04 | — | — | CN | disclosed |