Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CCR2 | P41597 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.42 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | RHOC | P08134 | 3/20 | 0.41 |
| ▸ | RHOA | P61586 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL29658337 | 1.00 | MEN1 (0.47) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL29658345 | 0.91 | CCR2 (0.51) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL29658390 | 0.91 | CCR2 (0.51) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL28735376 | 0.91 | CCR2 (0.51) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL28735377 | 0.91 | CCR2 (0.51) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL28735297 | 0.91 | CCR2 (0.51) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL29658406 | 0.89 | MEN1 (0.45) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL28735345 | 0.89 | MEN1 (0.45) | MEN1KMT2ACCR2KCNH2CACNA1I | |
| SCHEMBL28735422 | 0.84 | MEN1 (0.63) | MEN1KMT2AKCNH2CACNA1ICD274 | |
| SCHEMBL29658372 | 0.84 | MEN1 (0.63) | MEN1KMT2AKCNH2CACNA1ICD274 |
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-115340552-A | Heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2022-11-15 | — | — | CN | disclosed |
| CN-114478366-A | Pyridone derivative and application thereof in medicine | 海思科医药集团股份有限公司 | 2022-05-13 | — | — | CN | disclosed |