Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23160857 | 0.80 | KDM4E (0.48) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL6625289 | 0.76 | ALDH1A1 (0.52) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL1244647 | 0.75 | ALOX15 (0.54) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL6629825 | 0.75 | KDM4E (0.48) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL1244092 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL1244790 | 0.74 | RAB9A (0.50) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL1244777 | 0.74 | ALOX15 (0.55) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL30065648 | 0.74 | RAB9A (0.42) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL1244044 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL29847221 | 0.71 | HCAR2 (0.33) | — |
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-110194770-B | Peptidyl arginine deiminase inhibitors and uses thereof | 药捷安康(南京)科技股份有限公司 | 2022-08-09 | — | — | CN | disclosed |