Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5153000 | 0.85 | OPRD1 (0.42) | NR1H2NR1H3JAK2JAK1 | |
| SCHEMBL5159359 | 0.84 | KDM1A (0.42) | NR1H2NR1H3JAK2JAK1 | |
| SCHEMBL5156033 | 0.84 | KDM1A (0.42) | NR1H2NR1H3JAK2JAK1 | |
| SCHEMBL4709100 | 0.83 | NR1H2 (0.46) | AGTR2NR1H2NR1H3PARP1SIGMAR1 | |
| SCHEMBL4709252 | 0.83 | NR1H2 (0.46) | AGTR2NR1H2NR1H3PARP1SIGMAR1 | |
| SCHEMBL2017921 | 0.83 | NR1H2 (0.46) | AGTR2NR1H2NR1H3PARP1SIGMAR1 | |
| SCHEMBL26914975 | 0.81 | NR1H2 (0.46) | AGTR2NR1H2NR1H3PARP1SIGMAR1 | |
| SCHEMBL21274222 | 0.81 | NR1H2 (0.46) | AGTR2NR1H2NR1H3JAK2JAK1 | |
| SCHEMBL13340714 | 0.80 | NR1H2 (0.44) | AGTR2NR1H2NR1H3PARP1CA1 | |
| SCHEMBL4372410 | 0.80 | JAK2 (0.40) | AGTR2NR1H2NR1H3JAK2JAK1 |
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-1740573-A1 | AMIDES AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005108391-A1 | AMIDES AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |