Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10512435 | 0.80 | KMT2A (0.35) | HTTALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL9311569 | 0.79 | CYP2A6 (0.40) | ADORA1ADORA2AHTTALDH1A1RAB9A | |
| SCHEMBL18634828 | 0.76 | ADORA2B (0.41) | ADORA1ADORA2BHTTALDH1A1KMT2A | |
| SCHEMBL6353571 | 0.72 | ADORA1 (0.45) | ADORA1ADORA2BADORA2AHTTALDH1A1 | |
| SCHEMBL9536942 | 0.72 | PTGS2 (0.44) | HTTALDH1A1KMT2ARAB9ALMNA | |
| SCHEMBL421370 | 0.72 | ADORA1 (0.51) | ADORA1ADORA2BADORA2AALDH1A1KMT2A | |
| SCHEMBL3911337 | 0.71 | HTT (0.51) | HTTALDH1A1KMT2AMEN1RAB9A | |
| Hydrochloric Acid SCHEMBL29097687 | 0.71 | MAPK1 (0.48) | ADORA1ADORA2AHTTALDH1A1KMT2A | |
| SCHEMBL9310587 | 0.71 | FABP3 (0.43) | HTTALDH1A1KMT2AMEN1LMNA | |
| Hydrochloric Acid SCHEMBL28562921 | 0.69 | MAPK1 (0.47) | ADORA1ADORA2AHTTALDH1A1KMT2A |
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 |