Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 4/20 | 0.56 |
| ▸ | MMP2 | P08253 | 2/20 | 0.56 |
| ▸ | MMP12 | P39900 | 1/20 | 0.56 |
| ▸ | MMP1 | P03956 | 3/20 | 0.56 |
| ▸ | MMP3 | P08254 | 3/20 | 0.56 |
| ▸ | MMP7 | P09237 | 3/20 | 0.56 |
| ▸ | MMP13 | P45452 | 2/20 | 0.56 |
| ▸ | MMP8 | P22894 | 1/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | F13A1 | P00488 | 3/20 | 0.43 |
| ▸ | TGM2 | P21980 | 3/20 | 0.43 |
| ▸ | TGM1 | P22735 | 3/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1656829 | 0.88 | MMP9 (0.64) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL5546856 | 0.88 | MMP9 (0.64) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL2927761 | 0.85 | MMP9 (0.53) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL1655593 | 0.85 | MMP9 (0.77) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL1655818 | 0.85 | MMP9 (0.60) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL2928187 | 0.85 | MMP9 (0.52) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL2927874 | 0.84 | MMP9 (0.65) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL1656110 | 0.84 | MMP9 (0.65) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL2927673 | 0.83 | MMP9 (0.54) | MMP9MMP2MMP12MMP1MMP3 | |
| SCHEMBL2927653 | 0.76 | MMP9 (0.68) | MMP9MMP2MMP12MMP1MMP3 |
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-1768979-B1 | OCTAHYDROPYRROLO[2, 3, C]PYRIDINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | MERCK SERONO SA (CH) | 2010-09-29 | — | — | EP | claimed |