Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.60 |
| ▸ | PRKCG | P05129 | 1/20 | 0.59 |
| ▸ | NT5E | P21589 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL12698045 | 1.00 | GPBAR1 (0.60) | GPBAR1PRKCGNT5ELMNASMN1; SMN2 | |
| SCHEMBL9110039 | 1.00 | GPBAR1 (0.60) | GPBAR1PRKCGNT5ELMNASMN1; SMN2 | |
| SCHEMBL9110443 | 1.00 | GPBAR1 (0.60) | GPBAR1PRKCGNT5ELMNASMN1; SMN2 | |
| SCHEMBL9104978 | 1.00 | GPBAR1 (0.60) | GPBAR1PRKCGNT5ELMNASMN1; SMN2 | |
| SCHEMBL9888552 | 0.95 | — | — | |
| SCHEMBL19967462 | 0.93 | EGLN2 (0.61) | — | |
| SCHEMBL17756310 | 0.93 | — | — | |
| SCHEMBL9108197 | 0.93 | — | — | |
| SCHEMBL17755644 | 0.92 | — | — | |
| SCHEMBL9888601 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017025901-A1 | NOVEL C28-ANALOGUES WITH C3-MODIFICATIONS OF TRITERPENE DERIVATIVES AS HIV INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2017-02-16 | — | — | WO | disclosed |