Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.68 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | BACE1 | P56817 | 1/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.56 |
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.55 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KRAS | P01116 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29011908 | 0.90 | ACHE (0.76) | CTSLACHEBACE1ABCG2MAPT | |
| SCHEMBL29011912 | 0.88 | ABCG2 (0.72) | ACHEBACE1ABCG2MAPTTNFRSF1A | |
| SCHEMBL29011937 | 0.86 | MAPT (0.67) | ABCG2MAPTCAPN1PARP1MAOA | |
| SCHEMBL18742804 | 0.81 | ABCG2 (0.86) | CTSLABCG2MAPTCAPN1PARP1 | |
| SCHEMBL25202393 | 0.81 | CTSL (1.00) | CTSLACHEBACE1ABCG2MAPT | |
| SCHEMBL29011895 | 0.81 | TNFRSF1A (0.67) | ABCG2MAPTTNFRSF1ASMN1; SMN2KDM4E | |
| SCHEMBL25239854 | 0.80 | ACHE (0.81) | CTSLACHEBACE1ABCG2MAPT | |
| SCHEMBL31436346 | 0.77 | TUBB1 (0.76) | CTSLACHEBACE1ABCG2MAPT | |
| SCHEMBL31436340 | 0.77 | TUBB1 (0.76) | CTSLACHEBACE1ABCG2MAPT | |
| SCHEMBL30674789 | 0.76 | MCL1 (0.81) | CTSLACHEBACE1ABCG2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116023247-A | 2-propylene-1 ketone compound and preparation method and application thereof | 暨南大学 | 2023-04-28 | — | — | CN | claimed |
| CN-116023247-A | 2-propylene-1 ketone compound and preparation method and application thereof | 暨南大学 | 2023-04-28 | — | — | CN | disclosed |