Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | CHKA | P35790 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 3/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.44 |
| ▸ | PRMT6 | Q96LA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2876452 | 0.87 | ALDH1A1 (0.61) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL20210279 | 0.87 | KDM4E (0.63) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL28636678 | 0.87 | ALDH1A1 (0.65) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL16497656 | 0.86 | CXCR4 (0.47) | ALDH1A1HTTHRH3 | |
| SCHEMBL17724080 | 0.86 | HRH3 (0.51) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL2232693 | 0.82 | ALDH1A1 (0.44) | ALDH1A1HTTKDM4ESMN1; SMN2CHKA | |
| SCHEMBL6225770 | 0.82 | ALDH1A1 (0.63) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL28192273 | 0.80 | ALDH1A1 (0.96) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL23135775 | 0.80 | POLB (0.65) | ALDH1A1HTTKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL27453853 | 0.80 | KCNH2 (0.50) | ALDH1A1HTTKDM4ESMN1; SMN2CHKA |
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-113454086-A | Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists | 百济神州有限公司 | 2021-09-28 | — | — | CN | disclosed |