Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16199569 | 0.74 | KMT2A (0.38) | KDM4EHSD17B10ALDH1A1ALOX15KMT2A | |
| SCHEMBL6948388 | 0.73 | ALDH1A1 (0.40) | KDM4EHSD17B10ALDH1A1KMT2AMEN1 | |
| SCHEMBL9235864 | 0.73 | NPC1 (0.44) | KDM4EHSD17B10ALDH1A1KMT2AMEN1 | |
| SCHEMBL9299422 | 0.71 | ALDH1A1 (0.41) | KDM4EALDH1A1ALOX15KMT2AMEN1 | |
| SCHEMBL14141980 | 0.71 | ALDH1A1 (0.59) | KDM4EHSD17B10ALDH1A1ALOX15KMT2A | |
| SCHEMBL11151609 | 0.71 | ALDH1A1 (0.48) | KDM4EHSD17B10ALDH1A1ALOX15POLB | |
| SCHEMBL30388409 | 0.70 | NPC1 (0.65) | KDM4EALDH1A1KMT2AMEN1POLB | |
| SCHEMBL4806828 | 0.69 | ALDH1A1 (0.54) | KDM4EHSD17B10ALDH1A1KMT2AMEN1 | |
| SCHEMBL13481166 | 0.69 | ALDH1A1 (0.50) | KDM4EHSD17B10ALDH1A1KMT2AMEN1 | |
| SCHEMBL11172727 | 0.69 | ALDH1A1 (0.49) | KDM4EALDH1A1KMT2AMEN1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022161480-A1 | SUBSTITUTED BICYCLO-AROMATIC HETEROCYCLIC AMINE INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 苏州泽璟生物制药股份有限公司 | 2022-08-04 | — | — | WO | disclosed |
| CN-114835719-A | Substituted bicyclic aromatic heterocyclic amine inhibitor and preparation method and application thereof | 苏州泽璟生物制药股份有限公司 | 2022-08-02 | — | — | CN | disclosed |