Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27711466 | 1.00 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL11336456 | 0.83 | MEN1 (0.64) | ALDH1A1KMT2AMEN1L3MBTL1CYP2C19 | |
| SCHEMBL11336452 | 0.83 | MEN1 (0.64) | ALDH1A1KMT2AMEN1L3MBTL1CYP2C19 | |
| SCHEMBL11281655 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL29175032 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL11284096 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL11565411 | 0.80 | ALDH1A1 (0.45) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL756836 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL756835 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 | |
| SCHEMBL29534084 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1KDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101133060-B | Enzyme inhibitors | CHROMA THERAPEUTICS LTD | 2013-06-05 | — | — | CN | disclosed |
| CN-101133060-A | Enzyme inhibitors | CHROMA THERAPEUTICS LTD (GB) | 2008-02-27 | — | — | CN | disclosed |