Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 5/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 10/20 | 0.48 |
| ▸ | SPR | P35270 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5366609 | 0.86 | SPR (0.45) | NOTUMCYP11B2SPRNPSR1 | |
| SCHEMBL5331064 | 0.86 | SPR (0.45) | NOTUMCYP11B2SPRNPSR1 | |
| SCHEMBL5331062 | 0.84 | SPR (0.44) | CYP11B2SPRNPSR1 | |
| SCHEMBL14346538 | 0.76 | SPR (0.39) | CYP11B2SPRNPSR1 | |
| SCHEMBL9822279 | 0.76 | NOTUM (0.43) | NOTUMCYP11B2SPRTP53HSD17B3 | |
| SCHEMBL7218644 | 0.75 | NPSR1 (0.61) | NOTUMCYP11B2TP53NPSR1 | |
| SCHEMBL17492600 | 0.73 | NOTUM (0.52) | NOTUMCYP11B2TP53NPSR1 | |
| SCHEMBL14283934 | 0.72 | NOTUM (0.46) | NOTUMCYP11B2TP53NPSR1 | |
| SCHEMBL5363352 | 0.71 | SPR (0.35) | SPR | |
| SCHEMBL5363349 | 0.71 | SPR (0.35) | SPR |
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-2007146230-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2007-12-21 | — | — | WO | disclosed |