Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 12/20 | 0.40 |
| ▸ | DRD3 | P35462 | 12/20 | 0.40 |
| ▸ | FSHR | P23945 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | GNRHR | P30968 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4563416 | 0.85 | LTB4R (0.36) | HTR2BALDH1A1 | |
| SCHEMBL4564083 | 0.84 | TSHR (0.42) | HTR2BALDH1A1 | |
| SCHEMBL4628825 | 0.80 | RARB (0.39) | FSHR | |
| SCHEMBL4564105 | 0.79 | PDE4A (0.37) | FSHRHTR2B | |
| SCHEMBL4598844 | 0.79 | HCRTR1 (0.34) | HTR2BALDH1A1 | |
| SCHEMBL4597474 | 0.79 | SIGMAR1 (0.37) | — | |
| SCHEMBL4566254 | 0.78 | PDK2 (0.41) | — | |
| SCHEMBL4566136 | 0.78 | PDK2 (0.41) | — | |
| SCHEMBL4565660 | 0.78 | PDK2 (0.41) | FSHRNPC1RAB9A | |
| SCHEMBL4629499 | 0.77 | HSP90AA1 (0.39) | DRD2DRD3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2125825-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008079139-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-07-03 | — | — | WO | disclosed |