Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.32 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28632681 | 0.80 | CHRNB2 (0.41) | EPHX1CHRM1L3MBTL1CHRNB2CHRNA4 | |
| SCHEMBL14422645 | 0.72 | CYP3A4 (0.43) | CYP1A2SCN9ACHRM1FKBP1ACYP3A4 | |
| SCHEMBL15014485 | 0.72 | EPHX1 (0.42) | EPHX1MAPK1LMNATSHR | |
| SCHEMBL12584816 | 0.70 | CHRNB2 (0.36) | EPHX1CHRM1CYP3A4CHRNB2CHRNA4 | |
| SCHEMBL11277741 | 0.70 | ALDH1A1 (0.38) | FKBP1AMAPT | |
| SCHEMBL7608822 | 0.69 | ALDH1A1 (0.37) | CYP1A2CHRM1CYP3A4CHRNB2CHRNA4 | |
| SCHEMBL25382656 | 0.68 | ALDH1A1 (0.36) | CYP1A2CYP3A4TSHRHSD17B10MAPT | |
| SCHEMBL18957956 | 0.68 | EPHX1 (0.40) | EPHX1CHRM1CHRNB2CHRNA4CHRM2 | |
| SCHEMBL25382660 | 0.67 | FFAR3 (0.33) | CYP1A2CYP3A4TSHRHSD17B10MAPT | |
| SCHEMBL15712632 | 0.67 | ALDH1A1 (0.39) | CHRM1CHRNB2CHRNA4CHRM2CHRM4 |
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-2023014979-A1 | CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR KRAS G12C PROTEINS | RAYZEBIO, INC. (US) | 2023-02-09 | — | — | WO | disclosed |