Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | PIM1 | P11309 | 2/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 7/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5139974 | 0.79 | LMNA (0.42) | — | |
| SCHEMBL7371855 | 0.73 | HTR7 (0.58) | HTR2CNCF1ADRB2HTR6 | |
| SCHEMBL5067034 | 0.72 | HRH3 (0.50) | HTR2CHRH3HTR6 | |
| SCHEMBL10077100 | 0.70 | HTR2C (0.40) | HTR2CPIM1PIM2NCF1ADRB2 | |
| SCHEMBL2799253 | 0.70 | HTR2C (0.60) | HTR2CPIM1PIM2NCF1ADRB2 | |
| SCHEMBL13118690 | 0.70 | ADRB2 (0.50) | HTR2CPIM1NCF1ADRB2 | |
| SCHEMBL29359704 | 0.68 | HTR2A (0.61) | HTR2CNCF1ADRB2 | |
| SCHEMBL5022702 | 0.68 | HTR2A (0.61) | HTR2CNCF1ADRB2 | |
| SCHEMBL13117223 | 0.67 | HTR2C (0.49) | HTR2CPIM1PIM2 | |
| SCHEMBL5088 | 0.66 | HTR2C (0.50) | HTR2CNCF1ADRB2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1893607-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-03-05 | — | — | EP | claimed |
| WO-2006135604-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2006-12-21 | — | — | WO | claimed |
| EP-1893607-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006135604-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2006-12-21 | — | — | WO | disclosed |