Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.36 |
| ▸ | ABL1 | P00519 | 7/20 | 0.36 |
| ▸ | YES1 | P07947 | 7/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 6/20 | 0.36 |
| ▸ | PIM1 | P11309 | 6/20 | 0.36 |
| ▸ | KDR | P35968 | 6/20 | 0.36 |
| ▸ | HIPK1 | Q86Z02 | 6/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.34 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2339108 | 0.99 | MAP4K1 (0.37) | KDM5BCAMK2DMAP4K1TRPV3MAPK1 | |
| SCHEMBL2276975 | 0.80 | ATR (0.41) | KDM5BCAMK2DMAP4K1TRPV3MAPK1 | |
| SCHEMBL2275354 | 0.80 | JAK3 (0.40) | KDM5BCAMK2DMAP4K1MAPK1PRKCI | |
| SCHEMBL2275232 | 0.80 | JAK3 (0.40) | KDM5BCAMK2DMAP4K1MAPK1PRKCI | |
| SCHEMBL2278185 | 0.79 | JAK3 (0.40) | MAP4K1MAPK1ABL1PRKCIKIT | |
| SCHEMBL2341699 | 0.77 | MAPK1 (0.33) | MAP4K1MAPK1ATRKARS1 | |
| SCHEMBL2280768 | 0.76 | SYK (0.56) | MAP4K1KIT | |
| SCHEMBL2344632 | 0.75 | JAK3 (0.55) | KDM5BTRPV3MAPK1PRKCIKIT | |
| SCHEMBL2361899 | 0.75 | JAK3 (0.39) | MAP4K1MAPK1PRKCIKITROCK2 | |
| SCHEMBL2281125 | 0.74 | JAK3 (0.54) | MAPK1PRKCIKITATR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2245033-B1 | PYRROLOPYRAZINE KINASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2011-08-31 | — | — | EP | claimed |