Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 17/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | EP300 | Q09472 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
| ▸ | RET | P07949 | 1/20 | 0.43 |
| ▸ | HCK | P08631 | 1/20 | 0.43 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.43 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.43 |
| ▸ | SIK1 | P57059 | 1/20 | 0.43 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.43 |
| ▸ | WNK3 | Q9BYP7 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL409485 | 0.91 | CREBBP (0.57) | AURKABRD4EP300CREBBPLMNA | |
| SCHEMBL406603 | 0.86 | AURKA (0.50) | AURKAEP300CREBBPAURKB | |
| SCHEMBL408109 | 0.84 | ERBB2 (0.47) | AURKAAURKBMAPK13CHEK2NTRK1 | |
| SCHEMBL407681 | 0.84 | NPC1 (0.52) | AURKAERBB2PTK6MAPT | |
| SCHEMBL10139772 | 0.82 | AURKA (0.62) | AURKABRD4EP300CREBBPAURKB | |
| SCHEMBL405109 | 0.81 | CREBBP (0.59) | AURKABRD4EP300CREBBPAURKB | |
| SCHEMBL407222 | 0.80 | CREBBP (0.61) | AURKABRD4EP300CREBBPLMNA | |
| SCHEMBL407376 | 0.80 | BAZ2B (0.47) | BRD4EP300CREBBPLMNAMAPT | |
| SCHEMBL10139981 | 0.78 | CREBBP (0.63) | BRD4EP300CREBBPEGFRPTK6 | |
| SCHEMBL408492 | 0.78 | AURKA (0.56) | AURKAAURKBMAPK13CHEK2NTRK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2367822-B1 | TRICYCLIC AZAINDOLES | MERCK PATENT GMBH (DE) | 2016-10-05 | — | — | EP | claimed |
| US-8853391-B2 | Tricyclic azaindoles | MERCK PATENT GMBH (DE) | 2014-10-07 | — | — | US | claimed |
| WO-2010080253-A1 | TRICYCLIC AZAINDOLES | MERCK PATENT GMBH (DE) | 2010-07-15 | — | — | WO | claimed |
| EP-2367822-B1 | TRICYCLIC AZAINDOLES | MERCK PATENT GMBH (DE) | 2016-10-05 | — | — | EP | disclosed |
| US-8853391-B2 | Tricyclic azaindoles | MERCK PATENT GMBH (DE) | 2014-10-07 | — | — | US | disclosed |