Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | DBH | P09172 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23178957 | 0.86 | ACHE (0.50) | KDM4EALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL11533768 | 0.83 | KDM4E (0.63) | KDM4EALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL17967915 | 0.83 | MEN1 (0.44) | KDM4EALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL2821325 | 0.82 | ALDH1A1 (0.42) | KDM4EALDH1A1GAAHTT | |
| SCHEMBL17946120 | 0.81 | DRD4 (0.55) | KDM4EALDH1A1TDP1POLBSMN1; SMN2 | |
| SCHEMBL30815930 | 0.81 | DRD4 (0.55) | KDM4EALDH1A1TDP1POLBSMN1; SMN2 | |
| SCHEMBL6939806 | 0.80 | SIGMAR1 (0.49) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL1604858 | 0.77 | SIGMAR1 (0.46) | ALDH1A1MEN1KMT2AACHESMN1; SMN2 | |
| SCHEMBL8108284 | 0.77 | SIGMAR1 (0.46) | ALDH1A1MEN1KMT2AACHESMN1; SMN2 | |
| SCHEMBL3144826 | 0.76 | ALDH1A1 (0.65) | KDM4EALDH1A1DRD3HTT |
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-112574176-B | Heteroaryl compound and application thereof | 隆泰申医药科技(南京) 有限公司 | 2024-03-15 | — | — | CN | disclosed |
| WO-2021057696-A1 | HETEROARYL COMPOUND AND APPLICATION THEREOF | 隆泰申医药科技(南京)有限公司 | 2021-04-01 | — | — | WO | disclosed |
| CN-112574176-A | Heteroaryl compound and application thereof | 隆泰申医药科技(南京) 有限公司 | 2021-03-30 | — | — | CN | disclosed |