Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL22752346 | 0.93 | HCAR2 (0.32) | HCAR2ESR1ESR2 | |
| SCHEMBL22452947 | 0.89 | HCAR2 (0.34) | HCAR2CYP11B1CYP11B2 | |
| SCHEMBL19176941 | 0.87 | CNR2 (0.35) | — | |
| SCHEMBL22752359 | 0.87 | TLR8 (0.35) | ESR1ESR2 | |
| SCHEMBL26023635 | 0.84 | CNR2 (0.35) | — | |
| SCHEMBL19251066 | 0.82 | HCAR2 (0.32) | HCAR2ESR1ESR2CYP11B1CYP11B2 | |
| SCHEMBL18517108 | 0.81 | HCAR2 (0.32) | HCAR2ESR1ESR2 | |
| SCHEMBL19388317 | 0.80 | ESR1 (0.34) | ESR1ESR2 | |
| SCHEMBL23187572 | 0.79 | ESR1 (0.33) | ESR1ESR2 | |
| SCHEMBL19251551 | 0.78 | HCAR2 (0.34) | HCAR2CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9938236-B2 | Antiviral agents against HBV infection | DREXEL UNIVERSITY (US) | 2018-04-10 | — | — | US | disclosed |
| US-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |