Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.47 |
| ▸ | CETP | P11597 | 6/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | CCR6 | P51684 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL102298 | 0.85 | KIF11 (0.49) | KIF11KCNH2SCN10ACETPCCR6 | |
| SCHEMBL26965546 | 0.83 | KIF11 (0.49) | KIF11KCNH2SCN10ACETP | |
| SCHEMBL27076801 | 0.83 | KIF11 (0.49) | KIF11KCNH2SCN10ACETP | |
| SCHEMBL26965518 | 0.80 | PKM (0.54) | KIF11KCNH2SCN10ACETPCYP1A2 | |
| SCHEMBL11527555 | 0.80 | KIF11 (0.51) | KIF11CETPSLC6A2SLC6A3 | |
| SCHEMBL17552755 | 0.80 | KIF11 (0.49) | KIF11KCNH2SCN10ACETPCHRM2 | |
| SCHEMBL31177450 | 0.78 | CETP (0.45) | KIF11CETPNPC1GAAPKM | |
| SCHEMBL26394699 | 0.77 | KIF11 (0.43) | KIF11KCNH2SCN10ACETPGRM5 | |
| SCHEMBL26394642 | 0.77 | KIF11 (0.43) | KIF11KCNH2SCN10ACETPGRM5 | |
| SCHEMBL18737497 | 0.77 | KIF11 (0.47) | KIF11KCNH2SCN10ACETPCHRM2 |
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 |