Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.41 |
| ▸ | CCNC | P24863 | 2/20 | 0.39 |
| ▸ | CDK8 | P49336 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28046612 | 0.83 | DHODH (0.46) | ROCK2ROCK1 | |
| SCHEMBL28046611 | 0.82 | MAPT (0.54) | ROCK2ROCK1MAPTALDH1A1 | |
| SCHEMBL28046667 | 0.81 | KMO (0.42) | CHEK2CCNCCDK8MAPT | |
| SCHEMBL28046684 | 0.81 | KMO (0.44) | ROCK2ROCK1MAPTALDH1A1HSD17B14 | |
| SCHEMBL28046616 | 0.81 | PARP1 (0.47) | ALPLCHEK2ROCK2ROCK1ALDH1A1 | |
| SCHEMBL28046609 | 0.81 | CASP1 (0.43) | CHEK2ROCK2ROCK1 | |
| SCHEMBL28046664 | 0.81 | MAP4K4 (0.46) | ALPLCHEK2CCNCCDK8MAPT | |
| SCHEMBL28046610 | 0.80 | ROCK2 (0.54) | ALPLCA9ROCK2ROCK1TP53 | |
| SCHEMBL28046662 | 0.80 | JAK2 (0.43) | CCNCCDK8ROCK2ROCK1MAPT | |
| SCHEMBL28046613 | 0.79 | CDK5 (0.41) | CHEK2ROCK2ROCK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105294688-A | 6-chlorine-N-(substituted benzyl)-1H-pyrrolo[2,3-b]pyridine-2-amide compound and preparation method as well as application thereof | UNIV BEIJING TECHNOLOGY | 2016-02-03 | — | — | CN | disclosed |