Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 9/20 | 0.50 |
| ▸ | MMP9 | P14780 | 9/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7080833 | 0.82 | ALDH1A1 (0.58) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL1781793 | 0.79 | ALDH1A1 (0.55) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL1286243 | 0.79 | ALDH1A1 (0.55) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL1841406 | 0.79 | CASP3 (0.55) | MMP2MMP9ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL25234160 | 0.78 | GLS (0.55) | ALDH1A1MAPTNPSR1SMN1; SMN2CASP3 | |
| SCHEMBL30544887 | 0.78 | GLS (0.55) | ALDH1A1MAPTNPSR1SMN1; SMN2CASP3 | |
| SCHEMBL7286787 | 0.78 | CA12 (0.51) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL6579299 | 0.78 | MMP2 (0.52) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL7286779 | 0.78 | CA12 (0.51) | MMP2MMP9CA12CA9ALDH1A1 | |
| SCHEMBL876560 | 0.78 | SMN1; SMN2 (0.53) | MMP2MMP9CA12CA9ALDH1A1 |
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-0046712-B1 | FLUORINATED DIAMINOBUTANE DERIVATIVES | MERRELL TORAUDE ET COMPAGNIE (FR) | 1985-02-06 | — | — | EP | disclosed |
| US-4435425-A | INHIBITORS OF GAMMA-AMINOBUTYRIC ACID TRANSAMINASE | MERRELL TORAUDE ET COMPAGNIE (FR) | 1984-03-06 | — | — | US | disclosed |
| EP-0046712-A1 | Fluorinated diaminobutane derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1982-03-03 | — | — | EP | disclosed |