Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | BMPR1B | O00238 | 2/20 | 0.31 |
| ▸ | BMPR1A | P36894 | 2/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.31 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.30 |
| ▸ | AXL | P30530 | 1/20 | 0.30 |
| ▸ | MERTK | Q12866 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL9966413 | 0.88 | RIPK1 (0.37) | MAP4K4PIK3CAACVR1 | |
| SCHEMBL9966449 | 0.88 | MAP4K4 (0.33) | MAP4K4USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9966365 | 0.88 | USP2 (0.33) | MAP4K4USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9966486 | 0.87 | MAP4K4 (0.33) | MAP4K4USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9966380 | 0.85 | PIK3CA (0.33) | MAP4K4PIK3CAUSP2ALDH1A1TSHR | |
| SCHEMBL9966308 | 0.85 | ALOX5AP (0.33) | — | |
| SCHEMBL9966523 | 0.84 | IDO1 (0.36) | MAP4K4 | |
| SCHEMBL9966562 | 0.77 | MAP4K4 (0.44) | MAP4K4PIK3CAUSP2ALDH1A1TSHR | |
| SCHEMBL9966277 | 0.77 | ALOX5AP (0.38) | — | |
| SCHEMBL9966389 | 0.73 | ALOX5 (0.41) | MAP4K4ALDH1A1HDAC1 |
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 |