Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK2 | O43353 | 3/20 | 0.47 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4374398 | 0.86 | TLR8 (0.44) | RIPK2KDRMAPK14ARAPP | |
| SCHEMBL25872505 | 0.82 | ALDH1A1 (0.46) | RIPK2KDRMAPK14PARP1TRPV1 | |
| SCHEMBL30632276 | 0.80 | CDK8 (0.46) | ARPARP1SMN1; SMN2 | |
| SCHEMBL3935913 | 0.79 | HTR1A (0.50) | RIPK2KDRMAPK14ARPARP1 | |
| SCHEMBL20392593 | 0.79 | SLC22A12 (0.52) | RIPK2ARALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL28259104 | 0.79 | NR4A2 (0.56) | RIPK2ARPARP1KMT2AMAPT | |
| SCHEMBL13676600 | 0.76 | RIPK2 (0.45) | RIPK2KDRMAPK14ARTRPV1 | |
| SCHEMBL14242731 | 0.76 | PARP1 (0.44) | RIPK2KDRMAPK14PARP1TRPV1 | |
| SCHEMBL30819181 | 0.75 | PARP1 (0.47) | RIPK2KDRMAPK14PARP1MEN1 | |
| SCHEMBL1332713 | 0.75 | PARP1 (0.47) | RIPK2KDRMAPK14PARP1MEN1 |
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-104718211-A | Hcv ns3 protease inhibitors | MERCK SHARP & DOHME | 2015-06-17 | — | — | CN | disclosed |