Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200453 | 0.91 | MTNR1B (0.35) | ALDH1A1SMN1; SMN2TSHRCYP4F2CYP4A11 | |
| SCHEMBL14200447 | 0.90 | MAPK1 (0.36) | PTGS2SIGMAR1ALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL14200452 | 0.89 | SIGMAR1 (0.37) | PTGS2SIGMAR1ALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL14200442 | 0.87 | MAPK1 (0.37) | PTGS2SIGMAR1ALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL14200504 | 0.85 | KMT2A (0.43) | ALDH1A1SMN1; SMN2TDP1HDAC8HDAC6 | |
| SCHEMBL14200445 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL14201068 | 0.84 | RIPK1 (0.40) | ALDH1A1SMN1; SMN2L3MBTL1TDP1 | |
| SCHEMBL14200467 | 0.84 | MAPK1 (0.37) | PTGS2SIGMAR1ALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL14229381 | 0.84 | TP53 (0.41) | PTGS2SIGMAR1MAPK1L3MBTL1TSHR | |
| SCHEMBL14200490 | 0.83 | LTB4R2 (0.38) | PTGS2ALDH1A1SMN1; SMN2TSHRHDAC8 |
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 3 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 |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |