Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MPI | P34949 | 1/20 | 0.35 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4003688 | 0.71 | ALDH1A1 (0.50) | HRH3ALDH1A1KDM4EGAALMNA | |
| Formic Acid SCHEMBL30454705 | 0.71 | TLR9 (0.37) | ALDH1A1KDM4EGAANPC1TP53 | |
| Formic Acid SCHEMBL30455129 | 0.71 | JAK2 (0.39) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL10520545 | 0.70 | ALDH1A1 (0.44) | HRH3ALDH1A1KDM4EGAALMNA | |
| Bromide SCHEMBL2353004 | 0.69 | ALDH1A1 (0.49) | HRH3ALDH1A1KDM4EGAALMNA | |
| SCHEMBL13403443 | 0.69 | KDM4E (0.64) | ALDH1A1KDM4EGAALMNAGLA | |
| Formic Acid SCHEMBL30454470 | 0.68 | HDAC6 (0.31) | ALDH1A1KDM4EGAALMNAGLA | |
| SCHEMBL20713617 | 0.64 | PTGS1 (0.47) | ALDH1A1KDM4EGAALMNANPC1 | |
| SCHEMBL7991828 | 0.64 | JAK2 (0.40) | HRH3ALDH1A1KDM4EGAALMNA | |
| SCHEMBL19322146 | 0.61 | NPC1 (0.60) | HRH3ALDH1A1KDM4EGAAGLA |
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-116143708-A | Polysubstituted benzazepine heteroaryl derivative and application thereof | 四川汇宇制药股份有限公司 | 2023-05-23 | — | — | CN | disclosed |