Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.40 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30688863 | 0.82 | NTRK1 (0.45) | ALDH1A1KCNH2HTR2AHTR2CNTRK1 | |
| SCHEMBL2471248 | 0.81 | KDM1A (0.59) | ALDH1A1POLBKCNH2HTR2AHTR2C | |
| SCHEMBL22957698 | 0.80 | SLC6A4 (0.56) | ALDH1A1KCNH2HTR2ANTRK1SLC6A4 | |
| SCHEMBL22957691 | 0.76 | NTRK1 (0.44) | ALDH1A1KCNH2HTR2ANTRK1SLC6A4 | |
| SCHEMBL29125465 | 0.75 | HTR2A (0.41) | ALDH1A1KCNH2HTR2AHTR2CHTR2B | |
| SCHEMBL3291252 | 0.74 | MAPT (0.46) | ALDH1A1NTRK1KDM4EMEN1HTT | |
| SCHEMBL22957926 | 0.74 | NTRK1 (0.43) | ALDH1A1KCNH2HTR2ANTRK1KDM4E | |
| SCHEMBL29227076 | 0.74 | SLC6A5 (0.51) | ALDH1A1HTR2AMAOBHTTBCHE | |
| SCHEMBL30933761 | 0.74 | NPBWR1 (0.48) | ALDH1A1POLBKCNH2HTR2AKDM1A | |
| SCHEMBL30933758 | 0.74 | NPBWR1 (0.48) | ALDH1A1POLBKCNH2HTR2AKDM1A |
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-113278022-B | Pyrazolopyrimidine compound, pharmaceutical composition and application thereof | 南京纳丁菲医药科技有限公司 | 2023-12-12 | — | — | CN | disclosed |
| CN-113278022-A | Pyrazolopyrimidine compounds, pharmaceutical compositions and uses thereof | 南京纳丁菲医药科技有限公司 | 2021-08-20 | — | — | CN | disclosed |