Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28168037 | 0.88 | HTT (0.57) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL18508762 | 0.87 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL2728411 | 0.83 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL28835858 | 0.83 | TP53 (0.52) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL5240597 | 0.82 | ALDH1A1 (0.62) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL19551971 | 0.81 | MEN1 (0.81) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL19969740 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL17891993 | 0.80 | APEX1 (0.44) | ALDH1A1KMT2AMEN1SMN1; SMN2TP53 | |
| SCHEMBL11820871 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 | |
| SCHEMBL18113449 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1CYP3A4SMN1; SMN2 |
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-111377907-B | Polysubstituted phenylamino pyrimidine derivative and preparation method and application thereof | 杭州百新生物医药科技有限公司 | 2023-03-28 | — | — | CN | disclosed |