Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 8/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | BRAF | P15056 | 2/20 | 0.48 |
| ▸ | CDK7 | P50613 | 2/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.47 |
| ▸ | CDK1 | P06493 | 2/20 | 0.47 |
| ▸ | FES | P07332 | 2/20 | 0.47 |
| ▸ | ROS1 | P08922 | 2/20 | 0.47 |
| ▸ | FER | P16591 | 2/20 | 0.47 |
| ▸ | FLT4 | P35916 | 2/20 | 0.47 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | IRAK1 | P51617 | 2/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4107721 | 0.89 | BLK (0.47) | CDK8BRAFKDRBLKIMPDH2 | |
| SCHEMBL1368092 | 0.81 | PIK3CA (0.48) | CDK8KDM4ENPC1ALDH1A1LMNA | |
| SCHEMBL12143169 | 0.79 | CDK8 (0.54) | CDK8NPC1PKMRAB9ABRAF | |
| SCHEMBL29429732 | 0.76 | KDR (0.63) | CDK8KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL4128043 | 0.76 | KDR (0.63) | CDK8KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL12143154 | 0.75 | KIT (0.59) | CDK8NPC1RAB9ABRAFCDK7 | |
| SCHEMBL12143163 | 0.75 | PIK3CA (0.56) | CDK8BRAFCDK7ROCK2MAP4K4 | |
| SCHEMBL12143165 | 0.75 | CDK8 (0.55) | CDK8NPC1RAB9ABRAFCDK7 | |
| SCHEMBL12143170 | 0.75 | CDK8 (0.71) | CDK8BRAFCDK7ROCK2MAP4K4 | |
| SCHEMBL2040710 | 0.74 | RAB9A (0.65) | NPC1ALDH1A1LMNARAB9AROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8067599-B2 | Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors | HOFFMAN-LA ROCHE INC. (US) | 2011-11-29 | — | — | US | claimed |
| US-8067599-B2 | Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors | HOFFMAN-LA ROCHE INC. (US) | 2011-11-29 | — | — | US | disclosed |