Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229688 | 0.90 | TP53 (0.40) | TP53CYP4F2CYP4A11 | |
| SCHEMBL14229349 | 0.90 | TP53 (0.40) | TP53PTGS2SIGMAR1TSHRMAPK1 | |
| SCHEMBL14228932 | 0.89 | TP53 (0.43) | TP53PTGS2SIGMAR1TSHRMAPK1 | |
| SCHEMBL14229125 | 0.87 | MAPK1 (0.39) | TP53PTGS2SIGMAR1TSHRMAPK1 | |
| SCHEMBL14229027 | 0.84 | TP53 (0.42) | TP53PTGS2SIGMAR1TSHRMAPK1 | |
| SCHEMBL14229029 | 0.84 | MEN1 (0.45) | TP53TSHRTDP1MAPT | |
| SCHEMBL14200466 | 0.84 | PTGS2 (0.36) | PTGS2SIGMAR1TSHRMAPK1TDP1 | |
| SCHEMBL14229073 | 0.83 | L3MBTL1 (0.41) | TP53TSHRL3MBTL1MAPT | |
| SCHEMBL14229025 | 0.83 | ALDH1A1 (0.42) | TP53MAPT | |
| SCHEMBL14229162 | 0.82 | TP53 (0.50) | TP53PTGS2L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |