Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3934982 | 0.79 | KMT2A (0.58) | KMT2AGAAKDM4EMAPTHTT | |
| SCHEMBL11299688 | 0.75 | GAA (0.49) | KMT2AGAAKDM4EMAPTMEN1 | |
| SCHEMBL11547314 | 0.73 | ALDH1A1 (0.37) | KMT2AGAAKDM4EMAPTHTT | |
| SCHEMBL22307234 | 0.73 | TSHR (0.44) | KMT2AMEN1ALDH1A1POLBIDO1 | |
| SCHEMBL10619027 | 0.71 | TRPA1 (0.33) | KMT2AGAAKDM4EMAPTHTT | |
| SCHEMBL10992979 | 0.71 | TRPA1 (0.33) | KMT2AGAAKDM4EMAPTHTT | |
| SCHEMBL22307316 | 0.71 | KMT2A (0.58) | KMT2AGAAKDM4ENPC1MAPT | |
| SCHEMBL22307389 | 0.71 | KMT2A (0.58) | KMT2AGAAKDM4EMAPTHTT | |
| SCHEMBL12484685 | 0.71 | KMT2A (0.58) | KMT2AGAAKDM4ENPC1MAPT | |
| SCHEMBL11611806 | 0.70 | IDO1 (0.56) | KMT2AGAAEPHX1EPHX2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020156298-A1 | APPLICATION OF MALONONITRILE COMPOUND AS BACTERICIDE | 沈阳化工大学 | 2020-08-06 | — | — | WO | disclosed |