Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.56 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.56 |
| ▸ | CDK4 | P11802 | 2/20 | 0.51 |
| ▸ | CCND1 | P24385 | 2/20 | 0.51 |
| ▸ | GABRP | O00591 | 2/20 | 0.50 |
| ▸ | GABRD | O14764 | 2/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.50 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.50 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.50 |
| ▸ | GABRE | P78334 | 2/20 | 0.50 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.50 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.50 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.50 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3878246 | 0.81 | IMPDH2 (0.66) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL4892527 | 0.78 | IMPDH2 (0.56) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL3874790 | 0.78 | IMPDH2 (0.56) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL1635466 | 0.77 | ALDH1A1 (0.68) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL29380761 | 0.77 | ALDH1A1 (0.68) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL30490061 | 0.76 | GABRP (0.61) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL6009673 | 0.76 | GABRP (0.61) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| Ammonia Solution, Strong SCHEMBL28481259 | 0.75 | GABRP (0.59) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| SCHEMBL24032722 | 0.74 | GABRP (0.55) | IMPDH2IMPDH1CDK4CCND1GABRP | |
| Acetone SCHEMBL8602775 | 0.74 | IMPDH2 (0.56) | IMPDH2IMPDH1CDK4CCND1GABRP |
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-104860869-B | Compound with MEK kinase inhibition functions and preparation method and application | 北京大学 | 2017-11-03 | — | — | CN | disclosed |
| CN-104860869-A | Compound with MEK kinase inhibition function, and preparation method and application thereof | UNIV BEIJING | 2015-08-26 | — | — | CN | disclosed |