Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 7/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.66 |
| ▸ | TACR1 | P25103 | 8/20 | 0.37 |
| ▸ | CCR2 | P41597 | 3/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.35 |
| ▸ | TACR3 | P29371 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4971187 | 0.90 | CETP (0.65) | CETPKCNH2TACR1CCR2SLC6A9 | |
| SCHEMBL760260 | 0.79 | CETP (1.00) | CETPKCNH2 | |
| SCHEMBL760800 | 0.79 | CETP (1.00) | CETPKCNH2 | |
| SCHEMBL4969174 | 0.78 | CETP (0.48) | CETPKCNH2TACR1SLC6A9MEN1 | |
| SCHEMBL4966775 | 0.78 | CETP (0.43) | CETPKCNH2TACR1CCR2SLC6A9 | |
| SCHEMBL4967551 | 0.78 | CETP (0.43) | CETPKCNH2TACR1CCR2SLC6A9 | |
| SCHEMBL4970220 | 0.78 | CETP (0.43) | CETPKCNH2TACR1CCR2SLC6A9 | |
| SCHEMBL14244185 | 0.73 | CETP (0.61) | CETPKCNH2TACR1CCR2 | |
| SCHEMBL14244186 | 0.73 | CETP (0.61) | CETPKCNH2TACR1CCR2 | |
| SCHEMBL4721472 | 0.72 | CETP (0.41) | CETPKCNH2SLC6A9MEN1ALDH1A1 |
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-A2 | HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS | Brystol-Myers Squibb Company (US) | 2008-08-13 | — | — | EP | disclosed |
| WO-2007062308-A2 | HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-05-31 | — | — | WO | disclosed |