Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 2/20 | 0.39 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 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 | |
|---|---|---|---|---|
| SCHEMBL9538408 | 0.82 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9311982 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TP53TYRTSHRTAS2R38 | |
| SCHEMBL9537502 | 0.75 | L3MBTL1 (0.45) | BCAT2ALDH1A1TP53TYRTSHR | |
| SCHEMBL9539998 | 0.74 | ALDH1A1 (0.44) | BCAT2ALDH1A1TP53TYRTSHR | |
| SCHEMBL9537883 | 0.74 | CYP2A6 (0.47) | BCAT2ALDH1A1TP53TYRTSHR | |
| Hydrochloric Acid SCHEMBL7352630 | 0.74 | PTGS2 (0.59) | PTGS2ACLYALDH1A1CASP1LOXL2 | |
| SCHEMBL9536942 | 0.74 | PTGS2 (0.44) | PTGS2BCAT2ACLYALDH1A1ATR | |
| SCHEMBL5483549 | 0.73 | L3MBTL1 (0.50) | BCAT2ALDH1A1TP53TYRTSHR | |
| SCHEMBL937206 | 0.72 | PTGS2 (0.61) | PTGS2ACLYALDH1A1CASP1 | |
| SCHEMBL29415408 | 0.72 | PTGS2 (0.61) | PTGS2ACLYALDH1A1CASP1 |
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-0536151-A1 | ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM. | BOOTS CO PLC (GB) | 1993-04-14 | — | — | EP | disclosed |