Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL14200476 | 0.93 | LTB4R2 (0.44) | LTB4R2COMTTP53SMN1; SMN2LMNA | |
| SCHEMBL14200488 | 0.90 | LTB4R2 (0.39) | LTB4R2COMTTP53SMN1; SMN2LMNA | |
| SCHEMBL14200493 | 0.90 | LTB4R2 (0.40) | LTB4R2TP53SMN1; SMN2LMNAHTT | |
| SCHEMBL14543508 | 0.85 | TP53 (0.51) | LTB4R2COMTTP53SMN1; SMN2NPC1 | |
| SCHEMBL14200490 | 0.85 | LTB4R2 (0.38) | LTB4R2COMTTP53SMN1; SMN2LMNA | |
| SCHEMBL14200514 | 0.84 | LTB4R2 (0.42) | LTB4R2COMTTP53SMN1; SMN2NPC1 | |
| SCHEMBL14200479 | 0.84 | TAS1R3 (0.44) | TP53SMN1; SMN2LMNAHTTNPC1 | |
| SCHEMBL14200448 | 0.83 | ALDH1A1 (0.43) | LTB4R2SMN1; SMN2HTTNPC1RAB9A | |
| SCHEMBL14200467 | 0.83 | MAPK1 (0.37) | SMN1; SMN2HDAC8ALDH1A1 | |
| SCHEMBL14201000 | 0.83 | RIPK1 (0.40) | SMN1; SMN2LMNAHTTNPC1RAB9A |
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-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 |