Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17039174 | 0.87 | ACACB (0.50) | ACACBTSHRALDH1A1MAPTHTT | |
| SCHEMBL28346545 | 0.82 | MAPT (0.45) | ACACBTSHRALDH1A1MAPTHTT | |
| SCHEMBL17026722 | 0.78 | ALDH1A1 (0.45) | TSHRALDH1A1HTTMEN1KMT2A | |
| SCHEMBL17026751 | 0.71 | MMP2 (0.56) | ACACBTSHRALDH1A1MAPTHTT | |
| SCHEMBL4789041 | 0.71 | LMNA (0.56) | TSHRALDH1A1MAPTHTTMEN1 | |
| SCHEMBL17026740 | 0.71 | MMP2 (0.74) | ACACB | |
| SCHEMBL2369659 | 0.70 | TGM2 (0.49) | ALDH1A1MAPTHTTTP53MEN1 | |
| SCHEMBL20078579 | 0.70 | ACACB (0.48) | ACACBALDH1A1MAPTHTTTDP1 | |
| SCHEMBL18292434 | 0.68 | TSHR (0.63) | TSHRALDH1A1MAPTTDP1MEN1 | |
| SCHEMBL15504804 | 0.66 | MAPT (0.78) | TSHRALDH1A1MAPTTP53MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3107905-B1 | SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS | UNIV NOTRE DAME DU LAC (US) | 2018-09-19 | — | — | EP | disclosed |
| EP-3107905-A1 | SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS | University of Notre Dame du Lac (US) | 2016-12-28 | — | — | EP | disclosed |
| WO-2015127302-A1 | SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2015-08-27 | — | — | WO | disclosed |