Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.41 |
| ▸ | MMP1 | P03956 | 4/20 | 0.41 |
| ▸ | MMP2 | P08253 | 4/20 | 0.41 |
| ▸ | MMP9 | P14780 | 4/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28296314 | 0.78 | MAOB (0.44) | MAOBMMP1MMP2MMP9EGFR | |
| SCHEMBL698717 | 0.77 | TTR (0.53) | MAOBMAOATTRALOX5PTGS1 | |
| SCHEMBL698718 | 0.77 | TTR (0.53) | MAOBMAOATTRALOX5PTGS1 | |
| SCHEMBL28413171 | 0.70 | CYP2D6 (0.46) | TTRALOX5PTGS1PTGS2NFE2L2 | |
| SCHEMBL28413170 | 0.70 | CYP2D6 (0.46) | TTRALOX5PTGS1PTGS2NFE2L2 | |
| SCHEMBL28296312 | 0.70 | CYP2D6 (0.46) | TTRALOX5PTGS1PTGS2NFE2L2 | |
| SCHEMBL28411057 | 0.70 | HPGD (0.61) | MAOBMAOAMEN1LMNAMAPT | |
| SCHEMBL28524007 | 0.69 | TTR (0.46) | MAOBMAOATTRALOX5PTGS1 | |
| Benzoic Acid SCHEMBL20968915 | 0.69 | TTR (0.51) | MAOBTTRALOX5PTGS1PTGS2 | |
| SCHEMBL28408346 | 0.69 | MEN1 (0.45) | MEN1LMNAMAPTKMT2ANPC1 |
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-109796372-A | A method of preparing polysubstituted alkenyl amidine | 中国科学院化学研究所 | 2019-05-24 | — | — | CN | disclosed |