Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.47 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | TYK2 | P29597 | 1/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14060936 | 0.83 | DHFR (0.43) | ALDH1A1SMN1; SMN2ADRA2CNPC1RAB9A | |
| SCHEMBL27943408 | 0.82 | DRD2 (0.45) | ALDH1A1GAAMAPTTSHRHTT | |
| SCHEMBL27953736 | 0.81 | ALDH1A1 (0.51) | MAPKAPK2ALDH1A1MAPTTSHRSMN1; SMN2 | |
| SCHEMBL14059902 | 0.78 | CYP1A2 (0.47) | HRH4ALDH1A1TSHRADRA2CKCNH2 | |
| SCHEMBL14060813 | 0.76 | MAP4K1 (0.43) | HRH4ADRA2C | |
| SCHEMBL1384498 | 0.75 | KCNH2 (0.65) | ALDH1A1GAAMAPTTSHRHTT | |
| SCHEMBL27777918 | 0.75 | ALOX5 (0.50) | TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL27997677 | 0.73 | AGXT (0.43) | HRH4ALDH1A1GAAMAPTSMN1; SMN2 | |
| SCHEMBL2383528 | 0.71 | HRH4 (0.60) | HRH4MAPKAPK2GAAJAK2ADORA3 | |
| SCHEMBL21807648 | 0.71 | ESR2 (0.47) | ALDH1A1GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103703005-A | Tricyclic inhibitors of kinases | ABBOTT LAB | 2014-04-02 | — | — | CN | claimed |
| CN-103703005-A | Tricyclic inhibitors of kinases | ABBOTT LAB | 2014-04-02 | — | — | CN | disclosed |
| EP-2681221-A1 | TRICYCLIC INHIBITORS OF KINASES | AbbVie Inc. (US) | 2014-01-08 | — | — | EP | disclosed |
| WO-2012161812-A1 | TRICYCLIC INHIBITORS OF KINASES | ABBOTT LABORATORIES (US) | 2012-11-29 | — | — | WO | disclosed |