Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28512655 | 1.00 | DPP4 (0.40) | DPP4LMNAMMP1MMP2MMP3 | |
| Hydrochloric Acid SCHEMBL28905786 | 0.98 | DPP4 (0.39) | DPP4LMNAMMP1MMP2MMP3 | |
| Hydrochloric Acid SCHEMBL28905787 | 0.98 | DPP4 (0.39) | DPP4LMNAMMP1MMP2MMP3 | |
| Hydrochloric Acid SCHEMBL10925906 | 0.79 | DPP4 (0.39) | DPP4LMNAMMP1MMP2MMP3 | |
| SCHEMBL4827071 | 0.79 | PTGS1 (0.46) | DPP4LMNAMMP1MMP2MMP3 | |
| SCHEMBL15844936 | 0.77 | DPP4 (0.38) | DPP4LMNAMMP1MMP2MMP3 | |
| SCHEMBL15844937 | 0.77 | DPP4 (0.38) | DPP4LMNAMMP1MMP2MMP3 | |
| SCHEMBL18796583 | 0.77 | SLC7A5 (0.52) | DPP4LMNAALDH1A1SLC1A1SLC1A3 | |
| SCHEMBL17503630 | 0.77 | DPP4 (0.38) | DPP4LMNASMN1; SMN2ALDH1A1SLC1A1 | |
| SCHEMBL18030862 | 0.76 | DPP4 (0.37) | DPP4LMNAMMP1MMP2MMP3 |
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-109563082-B | Nuclear magnetic resonance imaging compound, intermediate thereof, nuclear magnetic resonance imaging agent and application thereof, and nuclear magnetic resonance imaging method | 北京市神经外科研究所 | 2021-03-30 | — | — | CN | disclosed |
| CN-107663228-B | Nuclear magnetic resonance imaging compound, nuclear magnetic resonance imaging agent and application thereof, and nuclear magnetic resonance imaging method | 北京市神经外科研究所 | 2021-01-19 | — | — | CN | disclosed |