Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KYNU | Q16719 | 1/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8968840 | 1.00 | KMT2A (0.40) | KMT2AMDM4MDM2LMNAALDH1A1 | |
| SCHEMBL24346571 | 0.89 | KMT2A (0.40) | KMT2AMDM4MDM2LMNAALDH1A1 | |
| SCHEMBL8968916 | 0.89 | KMT2A (0.40) | KMT2AMDM4MDM2LMNAALDH1A1 | |
| SCHEMBL29045237 | 0.89 | KMT2A (0.40) | KMT2AMDM4MDM2LMNAALDH1A1 | |
| SCHEMBL8968009 | 0.87 | CA2 (0.39) | ALDH1A1GAA | |
| SCHEMBL8967991 | 0.87 | CA2 (0.39) | ALDH1A1GAA | |
| SCHEMBL9300028 | 0.84 | CYP3A4 (0.39) | ALDH1A1TSHR | |
| SCHEMBL9299511 | 0.84 | CYP3A4 (0.39) | ALDH1A1TSHR | |
| SCHEMBL9299497 | 0.84 | CYP3A4 (0.39) | ALDH1A1TSHR | |
| SCHEMBL5799829 | 0.81 | KMT2A (0.43) | KMT2AMDM4MDM2LMNAALDH1A1 |
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-0613459-B1 | N-TRITYL ASPARTIC ACID DERIVATIVES FOR PREPARING PHOSPHONATE NMDA ANTAGONISTS | MERRELL DOW PHARMA (US) | 1996-03-06 | — | — | EP | disclosed |