Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | CA3 | P07451 | 1/20 | 0.56 |
| ▸ | MMP9 | P14780 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | APEX1 | P27695 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL27875336 | 0.89 | TSHR (0.50) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| SCHEMBL5756 | 0.89 | — | — | |
| SCHEMBL29392995 | 0.89 | — | — | |
| SCHEMBL31655518 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| SCHEMBL31655519 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| SCHEMBL31366240 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL5912983 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL5912996 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| Hydrochloric Acid SCHEMBL29026049 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 | |
| SCHEMBL27495804 | 0.86 | ESR2 (0.48) | KDM4EALDH1A1MAPTCA2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114561006-A | Melamine modified phthalonitrile resin and preparation method of composite material thereof | 四川金象赛瑞化工股份有限公司 | 2022-05-31 | — | — | CN | disclosed |