Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17039175 | 0.83 | SDCBP (0.47) | ALDH1A1MAPK14HPGDCYP3A4CYP1A2 | |
| SCHEMBL2369659 | 0.81 | TGM2 (0.49) | ALDH1A1HPGDSMN1; SMN2HTTGLA | |
| SCHEMBL314044 | 0.78 | MMP9 (0.44) | ALDH1A1SMN1; SMN2HTTGAARAB9A | |
| SCHEMBL10187426 | 0.78 | POLB (0.45) | ALDH1A1HPGDSMN1; SMN2HTTGAA | |
| SCHEMBL17026736 | 0.78 | ACACB (0.53) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL314128 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CYP3A4CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1728537 | 0.76 | MAPK14 (0.68) | ALDH1A1MAPK14HPGDCYP3A4CYP1A2 | |
| SCHEMBL10187467 | 0.75 | ALDH1A1 (0.39) | ALDH1A1HPGDCYP3A4CYP1A2CYP2C9 | |
| SCHEMBL9502734 | 0.75 | ALDH1A1 (0.39) | ALDH1A1HPGDCYP3A4CYP1A2CYP2C9 | |
| SCHEMBL12717349 | 0.75 | TEAD4 (0.42) | ALDH1A1HPGDSMN1; SMN2HTTRAB9A |
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-A1 | SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS | University of Notre Dame du Lac (US) | 2016-12-28 | — | — | EP | disclosed |
| WO-2016044844-A1 | ACCELERATION OF DIABETIC WOUND HEALING | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2016-03-24 | — | — | WO | disclosed |
| WO-2015127302-A1 | SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2015-08-27 | — | — | WO | disclosed |