Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAOA | P21397 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL12131039 | 0.84 | HDAC8 (0.60) | HDAC8HDAC6LMNAMAOAHRH3 | |
| SCHEMBL5068516 | 0.84 | HDAC8 (0.65) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL5675648 | 0.84 | CA12 (0.59) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL1479141 | 0.81 | CA12 (0.56) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL128190 | 0.81 | CA1 (0.70) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL87450 | 0.81 | CA1 (0.83) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL245250 | 0.80 | CA1 (0.63) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL12199135 | 0.80 | CA1 (0.68) | CA12CA1CA2ESR1CA7 | |
| SCHEMBL13679679 | 0.80 | HDAC8 (0.68) | HDAC8HDAC6POLBHRH3ACHE | |
| SCHEMBL7746905 | 0.79 | CA1 (0.79) | CA12CA1CA2ESR1CA7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4910206-A | Endotoxin induced lung injury | SANDOZ PHARMACEUTICALS CORP. (US) | 1990-03-20 | — | — | US | disclosed |