Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CPN1 | P15169 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | PHGDH | O43175 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8284598 | 0.89 | ALDH1A1 (0.64) | ALDH1A1NPC1KDM4EPOLBCPN1 | |
| Hydrochloric Acid SCHEMBL1692191 | 0.87 | ALDH1A1 (0.62) | ALDH1A1NPC1KDM4EPOLBCPN1 | |
| SCHEMBL21561085 | 0.84 | KDM4E (0.55) | ALDH1A1NPC1KDM4EPOLBCHRM1 | |
| SCHEMBL19203542 | 0.83 | ACHE (0.50) | ALDH1A1KDM4ECHRM1CPN1CPB2 | |
| SCHEMBL4714675 | 0.82 | MEN1 (0.56) | ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL4678853 | 0.79 | L3MBTL3 (0.50) | ALDH1A1KDM4ECPN1CPB2CYP2C9 | |
| SCHEMBL19196834 | 0.79 | MEN1 (0.40) | ALDH1A1KDM4ECHRM1CPN1CPB2 | |
| SCHEMBL13772828 | 0.79 | KDM4E (0.50) | ALDH1A1NPC1KDM4EPOLBMEN1 | |
| SCHEMBL14290100 | 0.78 | ALDH1A1 (0.53) | ALDH1A1NPC1POLBCPN1CPB2 | |
| SCHEMBL15450906 | 0.78 | KDM4E (0.51) | ALDH1A1NPC1KDM4EPOLBCHRM1 |
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-2023131167-A1 | COMPOUND FOR INHIBITING AND DEGRADING IRAK4, AND PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF | 海思科医药集团股份有限公司 | 2023-07-13 | — | — | WO | disclosed |