Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | GLA | P06280 | 3/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | HTR3A | P46098 | 1/20 | 0.58 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | HK1 | P19367 | 1/20 | 0.51 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8898511 | 0.99 | KDM4E (0.60) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL8891658 | 0.83 | ALDH1A1 (0.62) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL8891662 | 0.83 | KDM4E (0.65) | KDM4EALDH1A1GLAGAAHPGD | |
| Hydrochloric Acid SCHEMBL8900949 | 0.82 | ALDH1A1 (0.64) | KDM4EALDH1A1GLAGAAHPGD | |
| Hydrochloric Acid SCHEMBL8900954 | 0.82 | KDM4E (0.68) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL8890608 | 0.81 | HTR3A (0.63) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL8890147 | 0.81 | KDM4E (0.62) | KDM4EALDH1A1GLAGAAHPGD | |
| Hydrochloric Acid SCHEMBL8898518 | 0.80 | KDM4E (0.64) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL1083783 | 0.77 | HTR3A (0.73) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL742359 | 0.76 | KDM4E (0.94) | KDM4EALDH1A1GLAGAAHPGD |
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-1997020820-A1 | HETEROARYL COMPOUNDS | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | claimed |