Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 5/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.37 |
| ▸ | CA2 | P00918 | 5/20 | 0.37 |
| ▸ | CA9 | Q16790 | 5/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16808252 | 0.83 | CA12 (0.44) | CA12CA1CA2CA9MAPT | |
| SCHEMBL16808271 | 0.83 | CA12 (0.46) | CA12CA1CA2CA9MAPT | |
| SCHEMBL16808294 | 0.79 | NQO2 (0.45) | GABRB1GABRB2NPC1MAPTRAB9A | |
| SCHEMBL16808253 | 0.78 | SLC2A1 (0.49) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL16450827 | 0.78 | GAA (0.46) | CA12CA1CA2CA9MAPT | |
| SCHEMBL20185031 | 0.77 | CA12 (0.45) | CA12CA1CA2CA9MAPT | |
| SCHEMBL16808315 | 0.76 | PLAU (0.46) | NPC1MAPTRAB9ASMN1; SMN2THRA | |
| SCHEMBL12461908 | 0.76 | CA12 (0.47) | CA12CA1CA2CA9MAPT | |
| SCHEMBL16808218 | 0.76 | CA12 (0.46) | CA12CA1CA2CA9MAPT | |
| SCHEMBL16808225 | 0.75 | PPARA (0.46) | CA12CA1CA2CA9ITGB3 |
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-2015087857-A1 | ARYL AMIDINE COMPOUND AND BACTERICIDAL AGENT | 日本曹達株式会社 | 2015-06-18 | — | — | WO | disclosed |