Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | PAX8 | Q06710 | 3/20 | 0.57 |
| ▸ | GPX4 | P36969 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | POLQ | O75417 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229491 | 0.86 | RAB9A (0.57) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14201123 | 0.85 | NPC1 (0.41) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14201167 | 0.85 | ALDH1A1 (0.47) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL11346157 | 0.81 | RAB9A (0.64) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14200332 | 0.81 | ALDH1A1 (0.64) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL11651430 | 0.80 | RAB9A (0.63) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14201196 | 0.79 | MLYCD (0.38) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14201125 | 0.79 | ALDH1A1 (0.55) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14229121 | 0.79 | TP53 (0.69) | RAB9AALDH1A1NPC1PAX8GPX4 | |
| SCHEMBL14201129 | 0.79 | ALDH1A1 (0.44) | RAB9AALDH1A1NPC1PAX8GPX4 |
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 |