Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | DRD4 | P21917 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | LSS | P48449 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL11338748 | 0.92 | L3MBTL1 (0.51) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL9299546 | 0.92 | L3MBTL1 (0.51) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL11378746 | 0.90 | ALDH1A1 (0.47) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL8553182 | 0.83 | L3MBTL1 (0.61) | L3MBTL1ALDH1A1DRD3MAOB | |
| SCHEMBL6746220 | 0.82 | ALDH1A1 (0.61) | L3MBTL1ALDH1A1KDM4ECHRNA7LTA4H | |
| SCHEMBL15365357 | 0.81 | ALDH1A1 (0.59) | L3MBTL1ALDH1A1DRD3MAOB | |
| SCHEMBL18235025 | 0.80 | DRD4 (0.57) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL17445905 | 0.80 | ATM (0.60) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL11323712 | 0.80 | ALDH1A1 (0.59) | L3MBTL1ALDH1A1DRD4DRD2DRD3 | |
| SCHEMBL14330060 | 0.80 | L3MBTL1 (0.59) | L3MBTL1ALDH1A1DRD4DRD2DRD3 |
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-2022094420-A1 | SELECTIVE TRANSITION METAL CATALYZED DEUTERIUM INCORPORATION INTO ALKYNE AND ALKENE FUNCTIONALITIES | MARQUETTE UNIVERSITY (US) | 2022-05-05 | — | — | WO | disclosed |