Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 3/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | BMPR1B | O00238 | 11/20 | 0.31 |
| ▸ | BMPR1A | P36894 | 11/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 11/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 11/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 11/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9966536 | 0.82 | MAP4K4 (0.39) | MAP4K4HDAC1CYP2C9 | |
| SCHEMBL9936397 | 0.77 | MAP4K4 (0.47) | MAP4K4HDAC1KCNH2CYP2C9IDO1 | |
| SCHEMBL14295962 | 0.75 | MAP4K4 (0.50) | MAP4K4HDAC1BMPR1BBMPR1ATGFBR1 | |
| SCHEMBL9966522 | 0.72 | ALOX5AP (0.38) | — | |
| SCHEMBL9966514 | 0.71 | MAP4K4 (0.40) | MAP4K4HDAC1BMPR1BBMPR1ATGFBR1 | |
| SCHEMBL9966366 | 0.71 | MAP4K4 (0.46) | MAP4K4HDAC1KCNH2CYP2C9 | |
| SCHEMBL9966485 | 0.69 | MAP4K4 (0.38) | MAP4K4HDAC1CYP2C9MAPK1 | |
| SCHEMBL9966458 | 0.69 | GSK3B (0.46) | MAP4K4HDAC1CYP2C9 | |
| SCHEMBL9940268 | 0.69 | MAP4K4 (0.44) | MAP4K4HDAC1 | |
| SCHEMBL9966389 | 0.69 | ALOX5 (0.41) | MAP4K4HDAC1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012082817-A1 | BIARYLAMIDE INHIBITORS OF LEUKOTRIENE PRODUCTION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-21 | — | — | WO | disclosed |