Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL7579450 | 0.98 | TP53 (0.70) | TP53LMNAALDH1A1NPSR1MEN1 | |
| SCHEMBL4396092 | 0.90 | LMNA (0.77) | TP53LMNAALDH1A1NPSR1MEN1 | |
| SCHEMBL10054993 | 0.87 | MEN1 (0.74) | MEN1KMT2ATDP1BCHEMAOA | |
| SCHEMBL8251058 | 0.86 | GAA (0.74) | TP53ALDH1A1MEN1KMT2ATDP1 | |
| Ethylbenzene SCHEMBL27405402 | 0.84 | TP53 (0.93) | TP53ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Benzene SCHEMBL11697595 | 0.84 | MEN1 (0.78) | MEN1KMT2ATDP1BCHEMAOA | |
| SCHEMBL1654 | 0.84 | MEN1 (0.78) | MEN1KMT2ATDP1BCHEMAOA | |
| SCHEMBL5799878 | 0.84 | MEN1 (0.78) | MEN1KMT2ATDP1BCHEMAOA | |
| Diethylamine SCHEMBL23466778 | 0.83 | MEN1 (0.61) | TP53MEN1KMT2ATDP1SMN1; SMN2 | |
| Alcohol SCHEMBL5555254 | 0.83 | MEN1 (0.61) | TP53LMNAMEN1KMT2ATDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119350180-A | Industrial preparation method and application of high-purity alpha-aminonitrile | 哈尔滨理工大学 | 2025-01-24 | — | — | CN | claimed |
| CN-119350180-A | Industrial preparation method and application of high-purity alpha-aminonitrile | 哈尔滨理工大学 | 2025-01-24 | — | — | CN | disclosed |
| WO-2024091450-A1 | COMPOUNDS AND METHODS FOR TREATING CANCER | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2024-05-02 | — | — | WO | disclosed |