Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.46 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.46 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.46 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.46 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.46 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30803652 | 1.00 | MEN1 (0.49) | MEN1KMT2APSEN1PSEN2APH1B | |
| SCHEMBL21733480 | 0.84 | MEN1 (0.44) | MEN1KMT2APSEN1PSEN2APH1B | |
| SCHEMBL29999713 | 0.84 | MEN1 (0.44) | MEN1KMT2APSEN1PSEN2APH1B | |
| SCHEMBL29200689 | 0.84 | PTGDR2 (0.40) | MEN1KMT2ALMNATSHRALDH1A1 | |
| SCHEMBL29937019 | 0.84 | PTGDR2 (0.40) | MEN1KMT2ALMNATSHRALDH1A1 | |
| SCHEMBL30803568 | 0.80 | MEN1 (0.41) | MEN1KMT2APSEN1PSEN2APH1B | |
| SCHEMBL28903971 | 0.78 | NPC1 (0.51) | MEN1KMT2ALMNATSHRALDH1A1 | |
| SCHEMBL13728488 | 0.75 | ERAP1 (0.51) | MEN1KMT2ATSHRMAPTSMN1; SMN2 | |
| SCHEMBL21733481 | 0.74 | ALDH1A1 (0.36) | MEN1KMT2APSEN1PSEN2APH1B | |
| SCHEMBL22775885 | 0.72 | PTK2 (0.58) | MEN1KMT2ALMNATSHRALDH1A1 |
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-117659050-A | Quinazoline heterocyclic derivatives as KRAS mutation inhibitors for the treatment of cancer | 深圳福沃药业有限公司 | 2024-03-08 | — | — | CN | disclosed |