Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 17/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.36 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.36 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3344769 | 0.84 | ACACB (0.41) | ACACBPDK1CYP19A1TPSAB1TPSD1 | |
| SCHEMBL3346269 | 0.80 | PDK1 (0.42) | PDK1CYP19A1TPSAB1TPSD1TPSG1 | |
| SCHEMBL8313233 | 0.78 | F2 (0.49) | CYP19A1 | |
| SCHEMBL8313235 | 0.78 | F2 (0.49) | CYP19A1 | |
| SCHEMBL3038526 | 0.78 | ITGB1 (0.42) | ACACB | |
| SCHEMBL3038524 | 0.78 | ITGB1 (0.42) | ACACB | |
| SCHEMBL3042474 | 0.78 | ITGB1 (0.42) | ACACB | |
| SCHEMBL1491399 | 0.74 | CACNA1B (0.49) | PDK1TPSAB1TPSD1TPSG1 | |
| SCHEMBL1491397 | 0.74 | CACNA1B (0.49) | PDK1TPSAB1TPSD1TPSG1 | |
| SCHEMBL13424284 | 0.73 | MEP1B (0.38) | PDK1CYP19A1 |
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-2010043865-A1 | INHIBITORS OF HSP90 | CHROMA THERAPEUTICS LTD (GB) | 2010-04-22 | — | — | WO | disclosed |