Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29822623 | 1.00 | MMP2 (0.44) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29080002 | 0.91 | MMP2 (0.53) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29822774 | 0.85 | LMNA (0.61) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29079975 | 0.85 | MMP2 (0.47) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29079971 | 0.85 | MMP2 (0.47) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29080011 | 0.84 | HSD11B1 (0.56) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29079986 | 0.84 | MMP2 (0.46) | MMP2CA1CA2MAPTLMNA | |
| SCHEMBL29079987 | 0.82 | MMP2 (0.51) | MMP2MAPTLMNAPKMHSD11B1 | |
| SCHEMBL29079998 | 0.74 | NPC1 (0.48) | MMP2CA1CA2MAPTTHRB | |
| SCHEMBL29822485 | 0.72 | MMP2 (0.44) | MMP2CA1CA2MAPTLMNA |
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-114853664-B | Method for synthesizing alpha, beta-unsaturated cyclohexyl ketone compound under palladium catalysis condition | 河南大学 | 2023-09-29 | — | — | CN | disclosed |
| CN-114853664-A | Method for synthesizing alpha, beta-unsaturated heterocyclic hexyl ketone compound under palladium catalysis condition | 河南大学 | 2022-08-05 | — | — | CN | disclosed |