Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 10/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 9/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.33 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.33 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8057149 | 0.83 | P2RX7 (0.41) | P2RX7CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL18824255 | 0.79 | MAPK1 (0.46) | P2RX7CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL10927522 | 0.79 | P2RX7 (0.37) | P2RX7NR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL3670802 | 0.78 | SIGMAR1 (0.44) | P2RX7PRMT3CARM1PRMT6PRMT1 | |
| Hydrochloric Acid SCHEMBL3670800 | 0.74 | P2RX7 (0.41) | P2RX7CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL9199829 | 0.74 | SIGMAR1 (0.40) | P2RX7CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL11452553 | 0.72 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL506196 | 0.71 | RECQL (0.45) | PRMT3CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL4714894 | 0.71 | CHRNB2 (0.50) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL25533005 | 0.70 | P2RX7 (0.54) | P2RX7CHRNB2CHRNB4CHRNA3CHRNA7 |
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-1993003016-A1 | BENZIMIDAZOLONE DERIVATIVES AS 5-HT1A AND 5-HT2 ANTAGONISTS | BOEHRINGER INGELHEIM ITALIA S.P.A. (IT) | 1993-02-18 | — | — | WO | disclosed |