Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 5/20 | 0.42 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | MET | P08581 | 6/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 4/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.36 |
| ▸ | EGFR | P00533 | 3/20 | 0.36 |
| ▸ | PRKD2 | Q9BZL6 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4297287 | 0.88 | MAPK14 (0.39) | MAPK14MAPK13CES2CES1MET | |
| SCHEMBL4299805 | 0.77 | MAPK14 (0.39) | MAPK14MAPK13CES2CES1MET | |
| SCHEMBL4300045 | 0.74 | MAPK14 (0.52) | MAPK14CES2CES1METPRKD3 | |
| SCHEMBL8990691 | 0.74 | MAPK14 (0.52) | MAPK14CES2CES1METPRKD3 | |
| Hydrochloric Acid SCHEMBL3240832 | 0.73 | MAPK14 (0.51) | MAPK14CES2CES1METPRKD3 | |
| SCHEMBL12891157 | 0.71 | ALDH1A1 (0.40) | MAPK14KDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL9057179 | 0.70 | MAP4K4 (0.53) | MAPK14MAPK13METPRKD3MAP4K4 | |
| SCHEMBL4211846 | 0.68 | MAPK14 (0.68) | MAPK14MAPK13 | |
| SCHEMBL7278127 | 0.68 | CES2 (0.44) | MAPK14CES2CES1KDM4EALDH1A1 | |
| SCHEMBL4304056 | 0.67 | MAPK14 (0.42) | MAPK14MAPK13METPRKD3MAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009005675-A1 | NOVEL TRIAZOLOPYRIDAZINES | ABBOTT LABORATORIES (US) | 2009-01-08 | — | — | WO | disclosed |