Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | KLK7 | P49862 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PLAU | P00749 | 1/20 | 0.52 |
| ▸ | ELANE | P08246 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4414928 | 0.85 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL11668184 | 0.84 | SMN1; SMN2 (0.46) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 | |
| SCHEMBL1171462 | 0.79 | L3MBTL1 (0.65) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 | |
| SCHEMBL6171613 | 0.78 | RAB9A (1.00) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 | |
| SCHEMBL11221259 | 0.78 | RAB9A (0.50) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 | |
| SCHEMBL27583801 | 0.76 | ALDH1A1 (0.51) | ALDH1A1RAB9ASMN1; SMN2KLK7NPC1 | |
| SCHEMBL27932690 | 0.76 | ALDH1A1 (0.62) | ALDH1A1MAPTRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL4032340 | 0.75 | NPC1 (0.66) | ALDH1A1MAPTRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL11684699 | 0.75 | ALDH1A1 (0.74) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 | |
| SCHEMBL1171464 | 0.75 | ALDH1A1 (0.74) | ALDH1A1MAPTRAB9ASMN1; SMN2KLK7 |
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-112279743-B | Synthesis method of chiral alpha-amino acid ester derivative | 中国科学院大连化学物理研究所 | 2022-10-18 | — | — | CN | disclosed |
| CN-112279743-A | Synthesis method of chiral alpha-amino acid ester derivative | 中国科学院大连化学物理研究所 | 2021-01-29 | — | — | CN | disclosed |