Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | S100B | P04271 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL600597 | 0.77 | HTT (0.70) | HTTRAB9ATRPM8 | |
| SCHEMBL154420 | 0.77 | HTT (0.70) | HTTRAB9ATRPM8 | |
| SCHEMBL30170219 | 0.77 | S100B (0.49) | RAB9ANPC1ALDH1A1S100B | |
| SCHEMBL8809970 | 0.77 | S100B (0.49) | RAB9ANPC1ALDH1A1S100B | |
| SCHEMBL28518807 | 0.77 | S100B (0.49) | GFERRAB9ANPC1ALDH1A1S100B | |
| SCHEMBL28523002 | 0.74 | L3MBTL1 (0.49) | HTTGFERALDH1A1S100BMAPK1 | |
| SCHEMBL5316261 | 0.72 | S100B (0.50) | RAB9ANPC1ALDH1A1S100B | |
| SCHEMBL4062029 | 0.72 | S100B (0.50) | RAB9ANPC1ALDH1A1S100B | |
| SCHEMBL14804097 | 0.72 | NOS3 (0.50) | RAB9ANPC1ALDH1A1S100B | |
| SCHEMBL12528504 | 0.72 | KMT2A (0.52) | RAB9ANPC1ALDH1A1CASP3SENP8 |
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 |