Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13601726 | 0.84 | SMN1; SMN2 (0.45) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL5875276 | 0.83 | SMN1; SMN2 (0.44) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL1826048 | 0.81 | SMN1; SMN2 (0.67) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL7838421 | 0.81 | SMN1; SMN2 (0.67) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL11492059 | 0.81 | SMN1; SMN2 (0.67) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL13601680 | 0.81 | HPGD (0.56) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL1819086 | 0.81 | MAPT (0.61) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL1859157 | 0.79 | SMN1; SMN2 (0.69) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL6331933 | 0.79 | MAPT (0.62) | ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL13601725 | 0.78 | TSHR (0.49) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 |
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-105821013-A | Carbonyl reductase and application thereof in preparation of Chiral N-protecting-hydroxy nitrogen heterocycle | 华东理工大学 | 2016-08-03 | — | — | CN | disclosed |