Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL3902694 | 0.86 | CYP1A2 (0.38) | KCNA3ALDH1A1GAAGRM2GRM3 | |
| SCHEMBL6672006 | 0.86 | CYP1A2 (0.38) | KCNA3ALDH1A1GAAGRM2GRM3 | |
| SCHEMBL6672005 | 0.86 | CYP1A2 (0.38) | KCNA3ALDH1A1GAAGRM2GRM3 | |
| SCHEMBL3898562 | 0.86 | CYP1A2 (0.38) | KCNA3ALDH1A1GAAGRM2GRM3 | |
| Hydrochloric Acid SCHEMBL28060420 | 0.79 | CHEK2 (0.38) | CHEK2CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL7836998 | 0.78 | ALDH1A1 (0.44) | CHEK2ALDH1A1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL9907282 | 0.77 | CHEK2 (0.35) | CHEK2EPHX1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL13395635 | 0.75 | EPHX1 (0.32) | CHEK2EPHX1 | |
| SCHEMBL17930876 | 0.75 | ATM (0.42) | CHEK2ALDH1A1KDM4ECHRNB2CHRNB4 | |
| SCHEMBL26999088 | 0.75 | ATM (0.42) | CHEK2ALDH1A1KDM4ECHRNB2CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1363934-B1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH ANTIMICROBIAL ACTIVITY | POLYPHOR LTD (CH) | 2014-10-08 | — | — | EP | disclosed |