Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 5/20 | 0.33 |
| ▸ | BDKRB1 | P46663 | 3/20 | 0.33 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6524464 | 0.88 | ACVR1B (0.40) | S1PR3LCKACVR1BTGFBR1ACVRL1 | |
| SCHEMBL28048972 | 0.88 | LCK (0.39) | LCKBRAF | |
| SCHEMBL2523163 | 0.83 | PIM1 (0.36) | LCKBRAF | |
| SCHEMBL2522570 | 0.83 | LCK (0.38) | LCK | |
| SCHEMBL14800615 | 0.82 | PIM1 (0.37) | LCKBRAF | |
| SCHEMBL2518575 | 0.81 | NPC1 (0.38) | LCKADORA3ADORA2B | |
| SCHEMBL2521268 | 0.81 | LCK (0.37) | LCKBRAF | |
| SCHEMBL2523289 | 0.81 | MAPT (0.39) | LCKRORC | |
| SCHEMBL15573656 | 0.81 | LCK (0.41) | LCKBRAF | |
| SCHEMBL2522933 | 0.79 | PIM1 (0.41) | LCK |
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-102625807-B | 4-Substituted pyridin-3-yl-carboxamide compounds and methods of use | HOFFMAN-LA ROCHE LTD. (CH) | 2016-03-09 | — | — | CN | disclosed |