Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 11/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | TLR4 | O00206 | 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 | |
|---|---|---|---|---|
| SCHEMBL3392126 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL3390127 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL3390843 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL3390606 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL3389359 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL3388102 | 0.81 | ALOX5 (0.36) | ALOX5 | |
| SCHEMBL11577749 | 0.81 | TLR4 (0.33) | CYP19A1TLR4 | |
| SCHEMBL3983907 | 0.78 | TLR4 (0.40) | CYP19A1DDB1CRBNTLR4 | |
| SCHEMBL7911738 | 0.77 | PTGER2 (0.31) | — | |
| SCHEMBL14261321 | 0.74 | CYP19A1 (0.33) | CYP19A1 |
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-7501535-B2 | Chemical synthons and intermediates | PURDUE RESEARCH FOUNDATION (US) | 2009-03-10 | — | — | US | disclosed |