Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16612770 | 0.83 | ADRB2 (0.44) | KMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL16612796 | 0.83 | ADRB2 (0.55) | KMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL16612878 | 0.77 | KMT2A (0.46) | HTR2AKMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL4092925 | 0.73 | HTR2A (0.64) | HTR2AKDM4EHSD17B10HPGDGPR84 | |
| SCHEMBL28698891 | 0.72 | KDM4E (0.67) | HTR2AKDM4EHSD17B10HPGDGPR84 | |
| SCHEMBL16612954 | 0.70 | LMNA (0.53) | HTR2AHSD17B10TP53KMT2ALMNA | |
| SCHEMBL16612915 | 0.70 | APAF1 (0.45) | TP53KMT2AALDH1A1LMNA | |
| SCHEMBL8493237 | 0.70 | HTR2A (0.63) | HTR2AKDM4EHSD17B10HPGDGPR84 | |
| SCHEMBL588980 | 0.70 | ICMT (0.62) | HTR2AKDM4EGPR84KMT2AMEN1 | |
| SCHEMBL30958421 | 0.70 | ICMT (0.62) | HTR2AKDM4EGPR84KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |