Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9301963 | 0.90 | ALDH1A1 (0.36) | GRM5PIK3CGPIK3CDPIK3R1PIK3CA | |
| SCHEMBL9302233 | 0.88 | ALDH1A1 (0.39) | ALDH1A1HPGDKDM4ECHRM4KMT2A | |
| SCHEMBL9302209 | 0.88 | PIK3CD (0.35) | GRM5PIK3CGPIK3CDPIK3R1PIK3CA | |
| SCHEMBL9303648 | 0.81 | ACE (0.34) | CHRM4 | |
| SCHEMBL9847726 | 0.78 | KDM4E (0.40) | PIK3CGPIK3CDPIK3R1PIK3CAALDH1A1 | |
| SCHEMBL9303411 | 0.76 | ALDH1A1 (0.41) | GRM5ALDH1A1HPGDKDM4EKMT2A | |
| SCHEMBL6799741 | 0.72 | THRB (0.41) | ALDH1A1HPGDKDM4ELMNAHSD17B10 | |
| SCHEMBL9302393 | 0.70 | KDM4E (0.38) | PIK3CGPIK3CDPIK3R1PIK3CAALDH1A1 | |
| SCHEMBL9302145 | 0.70 | CRBN (0.38) | ALDH1A1SMN1; SMN2HPGDKDM4EKMT2A | |
| SCHEMBL9302286 | 0.69 | OPRM1 (0.38) | ALDH1A1SMN1; SMN2KDM4ELMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5283248-A | Bactericides, enzyme inhibitor of DNA-gyrase in bacteria | HOFFMANN-LA ROCHE INC. (US) | 1994-02-01 | — | — | US | disclosed |
| EP-0433648-A1 | Substituted pyrimidobenzimidazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1991-06-26 | — | — | EP | disclosed |