Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.42 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL29637136 | 0.83 | ALDH1A1 (0.60) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL7905250 | 0.83 | ALDH1A1 (0.60) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL28654498 | 0.80 | CYP2A6 (0.38) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL4442152 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL28224726 | 0.78 | CES1 (0.47) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL1436826 | 0.77 | PTPN1 (0.46) | ALDH1A1HSD17B10TSHRHPGDHPRT1 | |
| SCHEMBL28067095 | 0.77 | ALDH1A1 (0.59) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL27520658 | 0.77 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL4308375 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HSD17B10HIF1ATSHRHPGD | |
| SCHEMBL28968712 | 0.76 | HPRT1 (0.64) | ALDH1A1HSD17B10HIF1ATSHRHPGD |
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-109311839-B | Methylamine derivatives as lysyl oxidase inhibitors for the treatment of cancer | 癌症研究协会皇家癌症医院 | 2021-11-02 | — | — | CN | disclosed |
| CN-109311839-A | Methylamine derivative is used for treating cancer as lysyl oxidase inhibitor | 癌症研究协会皇家癌症医院 | 2019-02-05 | — | — | CN | disclosed |