Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 16/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22747883 | 0.90 | MAPT (0.50) | KDM4ESMN1; SMN2MAPTALDH1A1GAA | |
| SCHEMBL22760117 | 0.89 | FOLH1 (0.36) | MAPK8KDM4ESMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL22760451 | 0.86 | LMNA (0.34) | MAPK8MAPK9KDM4ESMN1; SMN2MAPT | |
| SCHEMBL22760170 | 0.85 | ALDH1A1 (0.36) | MAPK8MAPK9MAPTALDH1A1GAA | |
| SCHEMBL22760414 | 0.80 | EGFR (0.33) | KDM4EMAPTGAA | |
| SCHEMBL22760095 | 0.80 | MAPT (0.48) | KDM4ESMN1; SMN2MAPTALDH1A1GAA | |
| SCHEMBL22747829 | 0.77 | FOLH1 (0.35) | MAPK8SMN1; SMN2MAPTALDH1A1GAA | |
| SCHEMBL22760085 | 0.77 | EDNRA (0.37) | MAPK8MAPK9SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL22747868 | 0.77 | FOLH1 (0.35) | MAPK8SMN1; SMN2MAPTALDH1A1GAA | |
| SCHEMBL22760173 | 0.73 | ALDH1A1 (0.53) | KDM4ESMN1; SMN2MAPTALDH1A1GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |
| WO-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |
| CN-112028815-A | Indole derivatives and medical application thereof | 中国药科大学 | 2020-12-04 | — | — | CN | disclosed |