Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MLYCD | O95822 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | GPX4 | P36969 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | KCNQ3 | O43525 | 3/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200883 | 0.92 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL14201015 | 0.85 | NPSR1 (0.41) | ALDH1A1NPC1RAB9ALMNAMLYCD | |
| SCHEMBL14229428 | 0.85 | TP53 (0.50) | ALDH1A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL14200996 | 0.84 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL14201162 | 0.82 | MLYCD (0.36) | ALDH1A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL14229566 | 0.81 | RIPK1 (0.45) | SMN1; SMN2MLYCDMEN1KMT2A | |
| SCHEMBL14200835 | 0.79 | RIPK1 (0.33) | KCNQ3KCNQ2 | |
| SCHEMBL14201190 | 0.79 | MLYCD (0.44) | MLYCD | |
| SCHEMBL14200534 | 0.79 | MLYCD (0.40) | ALDH1A1NPC1RAB9AMLYCDTP53 | |
| SCHEMBL14200734 | 0.78 | RIPK1 (0.34) | SMN1; SMN2KCNQ3KCNQ2HDAC3HDAC1 |
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 |