Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 9/20 | 0.48 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.48 |
| ▸ | GRK2 | P25098 | 4/20 | 0.40 |
| ▸ | GRK3 | P35626 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL13823425 | 0.90 | GRK2 (0.53) | RAF1RIPK2GRK2GRK3ROCK2 | |
| SCHEMBL13823410 | 0.83 | RAF1 (0.50) | RAF1RIPK2GRK2GRK3ROCK2 | |
| SCHEMBL14136181 | 0.83 | RAF1 (0.50) | RAF1RIPK2GRK2GRK3ROCK2 | |
| SCHEMBL4444438 | 0.82 | RAF1 (0.72) | RAF1RIPK2MAPK13MAPK12MAPK11 | |
| SCHEMBL4441367 | 0.74 | RAF1 (0.73) | RAF1RIPK2GRK2GALR3MAPK13 | |
| SCHEMBL4443071 | 0.72 | RAF1 (0.61) | RAF1RIPK2GRK2GRK3MAPK13 | |
| SCHEMBL13815845 | 0.72 | RAF1 (0.72) | RAF1RIPK2MAPK13MAPK12MAPK11 | |
| SCHEMBL9892908 | 0.71 | EGFR (0.44) | KDM4EALDH1A1MAPTKMT2A | |
| SCHEMBL13823442 | 0.70 | ALDH1A1 (0.62) | HSD17B10KDM4EALDH1A1MAPTKMT2A | |
| SCHEMBL14402939 | 0.69 | RAF1 (0.49) | RAF1RIPK2HSD17B10MAPK14ALDH1A1 |
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-7476683-B2 | e.g. N-(4-Chloro-3-trifluoro methyl phenyl)-2-[3-(4-pyridinyloxy)phenyl amino]-acetamide; serine/threonine kinase inhibitor; anticarcinogenic, antiproliferative, antidiabetic agent; autoimmune diseases; atherosclerosis, arthritis, Crohn's disease, retinopaty | MERCK PATENT GMBH (DE) | 2009-01-13 | — | — | US | disclosed |