Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3857883 | 0.84 | HCAR3 (0.38) | CXCR2HCAR3BACE1KMT2A | |
| SCHEMBL3857887 | 0.84 | HCAR3 (0.38) | CXCR2HCAR3BACE1KMT2A | |
| SCHEMBL3854231 | 0.81 | HCAR3 (0.39) | CXCR2HCAR3 | |
| SCHEMBL3854237 | 0.81 | HCAR3 (0.39) | CXCR2HCAR3 | |
| SCHEMBL3855240 | 0.81 | HCAR3 (0.46) | CXCR2HCAR3BACE1KMT2A | |
| SCHEMBL3855243 | 0.81 | HCAR3 (0.46) | CXCR2HCAR3BACE1KMT2A | |
| SCHEMBL5159054 | 0.79 | HCAR3 (0.38) | HCAR3BACE1 | |
| SCHEMBL5158312 | 0.79 | CXCR2 (0.41) | CXCR2BACE1 | |
| SCHEMBL3853513 | 0.76 | HCAR3 (0.43) | HCAR3 | |
| SCHEMBL3853514 | 0.76 | HCAR3 (0.43) | HCAR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1740575-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-01-10 | — | — | EP | disclosed |
| 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 |
| WO-2005108358-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |