Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL681746 | 0.77 | ATM (0.38) | CA2GABRA1GABRB2 | |
| SCHEMBL12842827 | 0.72 | CA2 (0.32) | CA2 | |
| SCHEMBL5466692 | 0.70 | HSPA5 (0.36) | CA2 | |
| SCHEMBL12111327 | 0.66 | CA2 (0.34) | CA2GABRA1GABRB2 | |
| SCHEMBL682571 | 0.63 | CA2 (0.39) | CA2 | |
| SCHEMBL11387812 | 0.63 | ATM (0.48) | — | |
| SCHEMBL30735904 | 0.63 | ATM (0.48) | — | |
| SCHEMBL14583558 | 0.61 | CA2 (0.36) | CA2GABRA1GABRB2 | |
| SCHEMBL8038088 | 0.60 | TSHR (0.43) | — | |
| SCHEMBL21937989 | 0.60 | SMN1; SMN2 (0.44) | CA2GABRA1GABRB2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9624200-B2 | Therapeutic piperazines | DART NEUROSCIENCE (CAYMAN) LTD. (KY) | 2017-04-18 | — | — | US | disclosed |