Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL13550038 | 0.81 | TSHR (0.36) | — | |
| SCHEMBL5386744 | 0.79 | ESR2 (0.44) | — | |
| SCHEMBL13361283 | 0.79 | FFAR1 (0.31) | — | |
| SCHEMBL17761603 | 0.79 | GABRA1 (0.39) | PTGS2 | |
| SCHEMBL30876937 | 0.78 | LMNA (0.41) | BCHEACHEPTGS2 | |
| SCHEMBL5388771 | 0.77 | CRHR1 (0.38) | — | |
| SCHEMBL898540 | 0.74 | ESR1 (0.50) | BCHEACHEPTGS2 | |
| SCHEMBL14838622 | 0.72 | TAS1R3 (0.45) | — | |
| SCHEMBL12296727 | 0.71 | PTGS2 (0.49) | BCHEACHEPTGS2 | |
| Tetrahydrofuran SCHEMBL28631688 | 0.71 | POLB (0.35) | — |
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-20090275070-A1 | Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators | HOUSEY GERARD M | 2009-11-05 | — | — | US | disclosed |
| WO-2008091681-A2 | THERAMUTEIN MODULATORS | HOUSEY GERARD M (US) | 2008-07-31 | — | — | WO | disclosed |