Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CHUK | O15111 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 8/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28248947 | 0.78 | CYP2A6 (0.37) | ARGABRA1GABRB2SLC22A12 | |
| SCHEMBL29348046 | 0.69 | GABRA1 (0.34) | ARGABRA1GABRB2 | |
| SCHEMBL20057756 | 0.67 | XDH (0.42) | RORCS1PR1S1PR5XDH | |
| SCHEMBL18179359 | 0.67 | CYP2A6 (0.48) | AR | |
| SCHEMBL28376107 | 0.66 | SNCA (0.43) | AR | |
| SCHEMBL21533064 | 0.65 | AR (0.38) | ARXDH | |
| SCHEMBL1533878 | 0.65 | CYP2A6 (0.52) | — | |
| SCHEMBL21386583 | 0.65 | CYP2A6 (0.52) | — | |
| SCHEMBL91895 | 0.65 | CYP2A6 (0.52) | — | |
| SCHEMBL24233050 | 0.64 | GABRA1 (0.43) | RORCS1PR1GABRA1GABRB2 |
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-2024141757-A1 | LSD1 MODULATORS | EXSCIENTIA AI LIMITED (GB) | 2024-07-04 | — | — | WO | disclosed |