Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 2/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.44 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.44 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | FAP | Q12884 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28208958 | 1.00 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AMMP2PTGS2 | |
| SCHEMBL1068871 | 0.86 | MAPT (0.50) | ALDH1A1MMP2DPP4DPP7DPP8 | |
| SCHEMBL1859542 | 0.86 | MAPT (0.50) | ALDH1A1MMP2DPP4DPP7DPP8 | |
| Hydrochloric Acid SCHEMBL17707255 | 0.84 | ALDH1A1 (0.50) | ALDH1A1MMP2DPP4DPP7DPP8 | |
| Hydrochloric Acid SCHEMBL1859934 | 0.84 | ALDH1A1 (0.50) | ALDH1A1MMP2DPP4DPP7DPP8 | |
| Hydrochloric Acid SCHEMBL1859938 | 0.84 | ALDH1A1 (0.50) | ALDH1A1MMP2DPP4DPP7DPP8 | |
| SCHEMBL240405 | 0.84 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AMMP2DPP4 | |
| SCHEMBL3317059 | 0.84 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AMMP2DPP4 | |
| SCHEMBL4367409 | 0.84 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AMMP2DPP4 | |
| SCHEMBL11651148 | 0.84 | MMP2 (0.49) | ALDH1A1MMP2DPP4DPP7DPP8 |
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-107935875-A | A kind of synthetic method of melphalan | 兆科药业（广州）有限公司 | 2018-04-20 | — | — | CN | disclosed |