Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL19976594 | 0.89 | HCRTR1 (0.31) | HCRTR1HCRTR2 | |
| SCHEMBL16618503 | 0.85 | CYP3A4 (0.36) | HCRTR1HCRTR2 | |
| SCHEMBL16618711 | 0.73 | CYP3A4 (0.36) | HCRTR1HCRTR2 | |
| SCHEMBL1733111 | 0.70 | NOTUM (0.33) | — | |
| SCHEMBL16142677 | 0.69 | CYP3A4 (0.44) | HCRTR1HCRTR2 | |
| SCHEMBL14393994 | 0.69 | ALDH1A1 (0.33) | HCRTR1HCRTR2 | |
| SCHEMBL14754195 | 0.69 | CYP3A4 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL16135261 | 0.68 | CYP3A4 (0.40) | HCRTR1HCRTR2 | |
| SCHEMBL9914936 | 0.68 | CYP3A4 (0.43) | — | |
| SCHEMBL15273599 | 0.68 | CYP3A4 (0.43) | — |
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-9920073-B2 | Compositions useful for inhibiting HIV-1 infection and methods using same | DREXEL UNIVERSITY (US) | 2018-03-20 | — | — | US | disclosed |