Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.37 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28260621 | 1.00 | KMT2A (0.63) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL17825619 | 0.78 | KMT2A (0.63) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL17825618 | 0.78 | KMT2A (0.63) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL10478101 | 0.76 | MEN1 (0.47) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL17825638 | 0.75 | KMT2A (0.58) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL17825688 | 0.75 | KMT2A (0.58) | KMT2AALDH1A1KDM4EL3MBTL1HSD17B10 | |
| SCHEMBL27637733 | 0.74 | ALDH1A1 (0.39) | KMT2AALDH1A1KDM4EHSD17B10GAA | |
| SCHEMBL11658191 | 0.73 | KMT2A (0.65) | KMT2AL3MBTL1MAPTMEN1POLB | |
| Hydrochloric Acid SCHEMBL11661831 | 0.72 | KMT2A (0.63) | KMT2AL3MBTL1MAPTMEN1POLB | |
| SCHEMBL3020159 | 0.71 | ALDH1A1 (0.37) | KMT2AALDH1A1KDM4ESMN1; SMN2NPC1 |
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-109071498-A | Kinase inhibitor and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2018-12-21 | — | — | CN | disclosed |