Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 7/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 5/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.35 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9302145 | 0.88 | CRBN (0.38) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9302393 | 0.88 | KDM4E (0.38) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9303155 | 0.87 | HRH3 (0.38) | KDM4EALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL9847726 | 0.86 | KDM4E (0.40) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9301465 | 0.85 | ALDH1A1 (0.45) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| Hydrochloric Acid SCHEMBL9304165 | 0.84 | ALDH1A1 (0.45) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9302040 | 0.82 | KDM4E (0.41) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9302877 | 0.81 | GRM5 (0.39) | KDM4EALDH1A1LMNAHSD17B10HPGD | |
| SCHEMBL9302582 | 0.76 | ALDH1A1 (0.37) | KDM4EALDH1A1LMNAMAPTPIK3CA | |
| SCHEMBL9303487 | 0.75 | HDAC1 (0.34) | GPR174 |
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 |