Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.45 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | PLAT | P00750 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL28046669 | 0.85 | ROCK2 (0.48) | ADORA3ROCK2ROCK1ALDH1A1 | |
| SCHEMBL28046610 | 0.83 | ROCK2 (0.54) | ALPLADORA3ROCK2ROCK1KDM4E | |
| SCHEMBL28046666 | 0.80 | ROCK2 (0.56) | ADORA3ROCK2ROCK1PLAUPLAT | |
| SCHEMBL28046611 | 0.79 | MAPT (0.54) | ADORA3ROCK2ROCK1KDM4EMEN1 | |
| SCHEMBL28046662 | 0.75 | JAK2 (0.43) | ROCK2ROCK1ALDH1A1 | |
| SCHEMBL3883246 | 0.72 | FLT3 (0.67) | MEN1POLBKMT2A | |
| SCHEMBL28046615 | 0.71 | PARP1 (0.49) | ADORA3 | |
| SCHEMBL6689068 | 0.70 | CYP1A1 (0.64) | ALPLADORA3CSNK2A1KDM4EMEN1 | |
| SCHEMBL1429381 | 0.69 | PDGFRB (0.77) | KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL29540321 | 0.69 | PDGFRB (0.77) | KDM4EMEN1KMT2AALDH1A1 |
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 |