Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | GRM1 | Q13255 | 11/20 | 0.49 |
| ▸ | GRM5 | P41594 | 10/20 | 0.49 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.49 |
| ▸ | CDK7 | P50613 | 1/20 | 0.46 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.46 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.46 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2811392 | 0.82 | PDK4 (0.60) | NAMPTGRM1GRM5PDK4CYP11B2 | |
| SCHEMBL7831576 | 0.81 | PDK4 (0.58) | NAMPTGRM1GRM5PDK4CDK7 | |
| SCHEMBL29914645 | 0.80 | PDK4 (0.57) | NAMPTGRM1GRM5PDK4SOS1 | |
| SCHEMBL1364792 | 0.80 | PDK4 (0.57) | NAMPTGRM1GRM5PDK4SOS1 | |
| SCHEMBL13994079 | 0.79 | CDK9 (0.47) | NAMPTGRM1GRM5CDK9 | |
| SCHEMBL14500280 | 0.79 | CDK9 (0.54) | CDK9 | |
| SCHEMBL2239831 | 0.79 | NAMPT (0.66) | NAMPTGRM1GRM5PDK4 | |
| SCHEMBL4459006 | 0.79 | PDK4 (0.54) | NAMPTGRM1GRM5PDK4CDK7 | |
| SCHEMBL3988457 | 0.79 | PDK4 (0.56) | NAMPTGRM1GRM5PDK4CDK7 | |
| SCHEMBL13261659 | 0.79 | PDK4 (0.56) | NAMPTGRM1GRM5PDK4CDK7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013010453-A1 | CHEMOKING RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2013-01-24 | — | — | WO | disclosed |