Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1024573 | 0.80 | NOS3 (0.31) | — | |
| SCHEMBL3058558 | 0.79 | CA12 (0.32) | MMP1MMP2CA12CA1CA2 | |
| SCHEMBL14417043 | 0.78 | CRBN (0.36) | CRBNMMP1MMP2CA12CA1 | |
| SCHEMBL18882600 | 0.76 | CA12 (0.34) | MMP1MMP2CA12CA1CA2 | |
| SCHEMBL3061285 | 0.76 | CA12 (0.34) | MMP1MMP2CA12CA1CA2 | |
| SCHEMBL11501640 | 0.76 | CRBN (0.47) | CRBNCA2CA9TSHRALDH1A1 | |
| SCHEMBL3071611 | 0.75 | CRBN (0.43) | CRBNMMP1MMP2CA12CA1 | |
| SCHEMBL18882601 | 0.74 | ALDH1A1 (0.35) | MMP1MMP2CA1CA2TSHR | |
| SCHEMBL24463 | 0.73 | — | — | |
| SCHEMBL5848756 | 0.73 | MEN1 (0.39) | MMP1MMP2CA12CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3154953-A1 | DUAL INHIBITOR COMPOUNDS FOR USE IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS AND ALZHEIMER'S DISEASE | Fondazione Istituto Italiano di Tecnologia (IT) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015189830-A1 | DUAL INHIBITOR COMPOUNDS FOR USE IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS AND ALZHEIMER'S DISEASE | FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) | 2015-12-17 | — | — | WO | disclosed |