Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 8/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | TOP1 | P11387 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22087281 | 0.76 | KRAS (0.40) | TLR7TLR9HRH3 | |
| SCHEMBL28508529 | 0.71 | HRH3 (0.40) | TLR7TLR9SLC29A1KDM4EHRH3 | |
| SCHEMBL24525630 | 0.70 | KRAS (0.40) | SLC29A1 | |
| SCHEMBL21846179 | 0.66 | TEAD3 (0.37) | — | |
| SCHEMBL25021680 | 0.65 | CRHR1 (0.35) | TLR7HRH3LTA4H | |
| Hydrazine SCHEMBL9427083 | 0.64 | HRH4 (0.43) | KDM4EHRH3ALDH1A1 | |
| SCHEMBL7976583 | 0.62 | SLC29A1 (0.71) | TLR7SLC29A1KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7299207 | 0.61 | HTR2C (0.50) | TLR7TLR9SLC29A1 | |
| SCHEMBL22724624 | 0.60 | KRAS (0.47) | — | |
| SCHEMBL21912079 | 0.60 | BTK (0.37) | MEN1KMT2A |
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-2017201161-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2017-11-23 | — | — | WO | disclosed |