Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.50 |
| ▸ | CDK8 | P49336 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 4/20 | 0.45 |
| ▸ | GCK | P35557 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL24932144 | 0.81 | ALDH1A1 (0.52) | ABL1CDK8MEN1KMT2ANPC1 | |
| SCHEMBL28041 | 0.78 | PTK2 (0.61) | MEN1KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL8228538 | 0.77 | DEGS1 (0.49) | MEN1KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL2855460 | 0.77 | CDK8 (0.45) | CDK8NPC1RAB9A | |
| SCHEMBL4880831 | 0.76 | HTT (0.51) | CDK8NPC1RAB9AALDH1A1 | |
| SCHEMBL24932184 | 0.75 | MMP1 (0.52) | ABL1CDK8MEN1KMT2ANPC1 | |
| SCHEMBL15879088 | 0.75 | GSK3B (0.42) | MEN1KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL4889660 | 0.74 | CDK8 (0.67) | CDK8 | |
| SCHEMBL21394806 | 0.74 | L3MBTL1 (0.47) | ABL1CDK8MEN1KMT2ANPC1 | |
| SCHEMBL29357070 | 0.74 | L3MBTL1 (0.47) | ABL1CDK8MEN1KMT2ANPC1 |
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-110452238-B | Pyrimidinium compounds and uses thereof | 东莞市东阳光农药研发有限公司 | 2020-08-11 | — | — | CN | disclosed |