Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4865539 | 1.00 | CYP19A1 (0.34) | CYP19A1CREBBPHTR1AALDH1A1TSHR | |
| SCHEMBL4855306 | 0.87 | NR3C1 (0.35) | CREBBPHTR1APKMHTR2AHTR2C | |
| SCHEMBL4864334 | 0.86 | ADRA1D (0.35) | ADRA1DADRA1AADRA1B | |
| SCHEMBL4612431 | 0.86 | ADRA1D (0.35) | ADRA1DADRA1AADRA1B | |
| SCHEMBL4564249 | 0.86 | NR3C1 (0.31) | — | |
| SCHEMBL4866562 | 0.86 | HSP90AA1 (0.34) | LMNAKMT2AMEN1MAPTHTT | |
| SCHEMBL4564288 | 0.84 | HDAC4 (0.33) | CYP19A1HPGDADRA2AADRA2BADRA2C | |
| SCHEMBL4864081 | 0.84 | HSD11B1 (0.33) | — | |
| SCHEMBL4858243 | 0.84 | HDAC4 (0.33) | CYP19A1HPGDADRA2AADRA2BADRA2C | |
| SCHEMBL4608633 | 0.84 | HSD11B1 (0.33) | — |
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 |