Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 7/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8772017 | 0.83 | MMP2 (0.46) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8772004 | 0.81 | MMP2 (0.45) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8771806 | 0.78 | MMP2 (0.41) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8771913 | 0.74 | MMP2 (0.46) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8771761 | 0.74 | MMP2 (0.44) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8771989 | 0.70 | MMP2 (0.45) | MMP2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8771764 | 0.69 | MMP2 (0.54) | MMP2MMP3ALDH1A1MAPT | |
| SCHEMBL8771775 | 0.68 | MMP2 (0.46) | MMP2MMP3ALDH1A1HPGDMAPT | |
| Hydrochloric Acid SCHEMBL8771788 | 0.68 | MMP2 (0.53) | MMP2MMP3ALDH1A1MAPT | |
| SCHEMBL8771972 | 0.67 | MAPT (0.47) | ALDH1A1MAPTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0648740-B1 | AMINO ACID AMIDE DERIVATIVE, AGROHORTICULTURAL BACTERICIDE, AND PRODUCTION PROCESS | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1997-10-08 | — | — | EP | disclosed |