Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CTSD | P07339 | 2/20 | 0.54 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.54 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | CASR | P41180 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.52 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL16254370 | 1.00 | NPC1 (0.60) | NPC1RAB9AALDH1A1CTSDCARM1 | |
| SCHEMBL15892590 | 1.00 | NPC1 (0.60) | NPC1RAB9AALDH1A1CTSDCARM1 | |
| Hydrochloric Acid SCHEMBL15881247 | 0.99 | NPC1 (0.59) | NPC1RAB9AALDH1A1CTSDCARM1 | |
| Hydrochloric Acid SCHEMBL17335540 | 0.99 | NPC1 (0.59) | NPC1RAB9AALDH1A1CTSDCARM1 | |
| Hydrochloric Acid SCHEMBL20473203 | 0.99 | NPC1 (0.59) | NPC1RAB9AALDH1A1CTSDCARM1 | |
| SCHEMBL18492928 | 0.88 | GAA (0.59) | ALDH1A1CARM1PRMT6KMT2A | |
| SCHEMBL7413310 | 0.87 | ALPI (0.61) | ALDH1A1KMT2A | |
| SCHEMBL3114367 | 0.87 | ALPI (0.61) | ALDH1A1KMT2A | |
| SCHEMBL13073347 | 0.87 | KMT2A (0.63) | NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL21582601 | 0.87 | ALDH1A1 (0.60) | NPC1RAB9AALDH1A1CARM1PRMT6 |
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-108368133-A | Urea peptidomimetic boronic acid compounds and its pharmaceutical composition, preparation method and purposes | 北京大学 | 2018-08-03 | — | — | CN | disclosed |
| CN-106588965-A | Urea peptidomimetic boric acid compound as well as pharmaceutical composition, preparation method and application thereof | 北京大学 | 2017-04-26 | — | — | CN | disclosed |