Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28571748 | 0.79 | MYC (0.40) | MYCRAB9AMAPTKDM4ENPC1 | |
| SCHEMBL12713532 | 0.79 | APP (0.58) | CYP2A6APPMMP2MMP9MMP8 | |
| SCHEMBL221512 | 0.76 | CYP2A6 (0.54) | CYP2A6MYCAPPMMP2MMP9 | |
| SCHEMBL1736089 | 0.75 | MGAM (0.43) | CYP2A6APPMMP2MMP9MMP8 | |
| SCHEMBL28561897 | 0.72 | KDM4E (0.60) | MYCRAB9AMAPTKDM4ENPC1 | |
| SCHEMBL30443893 | 0.72 | KDM4E (0.60) | MYCRAB9AMAPTKDM4ENPC1 | |
| SCHEMBL28914040 | 0.71 | MYC (0.37) | MYCRAB9AMAPTKDM4ENPC1 | |
| SCHEMBL28561275 | 0.70 | MYC (0.41) | MYCRAB9AMAPTKDM4ENPC1 | |
| SCHEMBL28561269 | 0.70 | KDM4E (0.46) | APPMMP2MMP9MMP8MMP13 | |
| SCHEMBL28571758 | 0.69 | MYC (0.38) | MYCAPPRAB9AMAPTKDM4E |
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-108373476-B | Kinase inhibitor and preparation and application thereof | 成都地奥制药集团有限公司 | 2021-06-01 | — | — | CN | disclosed |