Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26134377 | 1.00 | KRAS (0.45) | KRASKMT2AMEN1PKML3MBTL1 | |
| SCHEMBL29385894 | 0.75 | HTR6 (0.42) | KRASKMT2AMEN1PKML3MBTL1 | |
| SCHEMBL30822596 | 0.72 | CA12 (0.74) | KRASKMT2ALMNASMN1; SMN2HTT | |
| SCHEMBL184045 | 0.72 | CA12 (0.74) | KRASKMT2ALMNASMN1; SMN2HTT | |
| Hydrochloric Acid SCHEMBL30822580 | 0.71 | CA12 (0.71) | KRASKMT2ALMNASMN1; SMN2HTT | |
| SCHEMBL5597547 | 0.71 | CA12 (0.71) | KRASKMT2ALMNASMN1; SMN2HTT | |
| SCHEMBL28129617 | 0.71 | CA12 (0.71) | KRASKMT2ALMNASMN1; SMN2HTT | |
| SCHEMBL28490326 | 0.70 | ALDH1A1 (0.45) | KMT2AMEN1PKML3MBTL1LMNA | |
| SCHEMBL28490325 | 0.70 | ALDH1A1 (0.45) | KMT2AMEN1PKML3MBTL1LMNA | |
| SCHEMBL28492017 | 0.70 | ALDH1A1 (0.45) | KMT2AMEN1PKML3MBTL1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023196975-A1 | COMPOUNDS THAT INTERACT WITH RAS SUPERFAMILY PROTEINS FOR TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE | SHY THERAPEUTICS, LLC (US) | 2023-10-12 | — | — | WO | disclosed |