Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29487819 | 0.89 | TRPA1 (0.39) | RECQLKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL31097138 | 0.86 | RECQL (0.43) | RECQLKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL47226 | 0.71 | CYP1A2 (0.47) | RECQLKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL29487677 | 0.71 | CYP1A2 (0.47) | RECQLKDM4EMEN1ALDH1A1LMNA | |
| Fluoride SCHEMBL31655450 | 0.70 | CYP1A2 (0.46) | RECQLKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL29487791 | 0.69 | TRPA1 (0.42) | RECQLALDH1A1LMNAMAPTHPGD | |
| SCHEMBL25392656 | 0.69 | — | — | |
| SCHEMBL31097157 | 0.69 | RECQL (0.32) | RECQL | |
| SCHEMBL20769904 | 0.69 | CHEK1 (0.41) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL31731004 | 0.69 | KMO (0.48) | — |
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-2022237178-A1 | BICYCLIC HETEROARYL DERIVATIVE AND PREPARATION METHOD THEREFOR AND USE THEREOF | 浙江海正药业股份有限公司 | 2022-11-17 | — | — | WO | disclosed |