Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL470472 | 0.73 | NOTUM (0.42) | — | |
| SCHEMBL902697 | 0.72 | GAA (0.32) | — | |
| SCHEMBL10081881 | 0.70 | KDM4E (0.40) | — | |
| SCHEMBL21834224 | 0.69 | HCAR2 (0.40) | HCAR2DAO | |
| SCHEMBL470311 | 0.64 | PDE4D (0.30) | — | |
| SCHEMBL22637228 | 0.63 | FABP4 (0.34) | HCAR2DAO | |
| SCHEMBL1663754 | 0.60 | PDE4D (0.59) | HCAR2TTRDAO | |
| SCHEMBL27575758 | 0.59 | HCAR2 (0.61) | HCAR2DAO | |
| SCHEMBL903102 | 0.59 | — | — | |
| SCHEMBL22637832 | 0.58 | HCAR2 (0.41) | HCAR2DAO |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012044531-A1 | NOVEL PIPERAZINE ANALOGS WITH SUBSTITUTED HETEROARYL GROUPS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-04-05 | — | — | WO | disclosed |
| WO-2012033736-A1 | NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-15 | — | — | WO | disclosed |