Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPAS1 | Q99814 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SGK1 | O00141 | 4/20 | 0.37 |
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL19014651 | 0.82 | ALDH1A1 (0.44) | HPGDSMN1; SMN2LMNAALDH1A1TSHR | |
| SCHEMBL8643797 | 0.79 | EPAS1 (0.43) | EPAS1CNR1GPR3CA1CA2 | |
| SCHEMBL8643794 | 0.79 | EPAS1 (0.43) | EPAS1CNR1GPR3CA1CA2 | |
| SCHEMBL10183655 | 0.79 | EPAS1 (0.43) | EPAS1BRD4HPGDCA1CA2 | |
| SCHEMBL16377391 | 0.78 | ALDH1A1 (0.46) | KAT6ABRD4THRBHPGDSMN1; SMN2 | |
| SCHEMBL2642188 | 0.78 | PTGS2 (0.46) | KAT6ABRD4THRBHPGDSMN1; SMN2 | |
| SCHEMBL12757010 | 0.78 | TSHR (0.53) | LMNAALDH1A1TSHR | |
| SCHEMBL26413808 | 0.77 | GAA (0.48) | KAT6ABRD4THRBHPGDSMN1; SMN2 | |
| SCHEMBL10235621 | 0.77 | ALDH1A1 (0.43) | EPAS1CNR1CA1CA2CA9 | |
| SCHEMBL1868082 | 0.77 | ALDH1A1 (0.35) | EPAS1ALDH1A1HTR2AHTR2CHTR2B |
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-1954668-B9 | HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2012-03-21 | — | — | EP | disclosed |
| EP-1954668-B1 | HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2011-09-28 | — | — | EP | disclosed |