Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6286281 | 0.89 | CES1 (0.39) | CES1MAPTGAASMN1; SMN2HDAC1 | |
| Trifluoroacetic Acid SCHEMBL6288018 | 0.89 | CES1 (0.39) | CES1MAPTGAASMN1; SMN2HDAC1 | |
| Trifluoroacetic Acid SCHEMBL6287794 | 0.74 | MLYCD (0.37) | CES1ALDH1A1HDAC1HDAC7HDAC8 | |
| Trifluoroacetic Acid SCHEMBL6290918 | 0.74 | MLYCD (0.37) | CES1ALDH1A1HDAC1HDAC7HDAC8 | |
| SCHEMBL7037687 | 0.74 | CCR5 (0.39) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL6286778 | 0.74 | LTA4H (0.52) | SMN1; SMN2NPC1RAB9ALTA4H | |
| Trifluoroacetic Acid SCHEMBL6284180 | 0.73 | MC3R (0.44) | — | |
| Trifluoroacetic Acid SCHEMBL6290842 | 0.73 | MC3R (0.44) | ALDH1A1MAPTSMN1; SMN2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6287205 | 0.72 | GAA (0.36) | MAPTGAASMN1; SMN2LTA4H | |
| Hydrochloric Acid SCHEMBL7108341 | 0.72 | GAA (0.36) | MAPTGAASMN1; SMN2LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| EP-1291341-A1 | COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2003-03-12 | — | — | EP | disclosed |