Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAMKK2 | Q96RR4 | 4/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 4/20 | 0.41 |
| ▸ | INSR | P06213 | 3/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14620968 | 0.90 | CAMKK2 (0.46) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL7985889 | 0.89 | VNN1 (0.46) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL858803 | 0.81 | CAMKK2 (0.44) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL15298804 | 0.75 | CAMKK2 (0.43) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL857545 | 0.75 | CAMKK2 (0.47) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL858429 | 0.74 | MAPK14 (0.52) | ALDH1A1NPSR1 | |
| SCHEMBL20086210 | 0.73 | CA1 (0.50) | ALDH1A1IKBKBKDR | |
| SCHEMBL857420 | 0.73 | MAPK13 (0.41) | — | |
| SCHEMBL857332 | 0.73 | CAMKK2 (0.46) | CAMKK2RIPK1CHUKINSRMAPK8 | |
| SCHEMBL14620869 | 0.73 | CAMKK2 (0.42) | CAMKK2RIPK1CHUKINSRMAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| US-8143271-B2 | Compounds and methods for kinase modulation, and indications therefor | PLEXXIKON INC. (US) | 2012-03-27 | — | — | US | disclosed |