Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MYC | P01106 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6645925 | 0.89 | POLB (0.48) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL27736140 | 0.81 | TSHR (0.53) | POLBLMNATSHRALDH1A1HSD17B10 | |
| SCHEMBL11421847 | 0.80 | POLB (0.44) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL9522854 | 0.80 | POLB (0.44) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL524457 | 0.77 | LMNA (0.53) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL29702037 | 0.77 | TSHR (0.63) | POLBNR4A2LMNATSHRALDH1A1 | |
| Dimethyl Phthalate SCHEMBL28079217 | 0.77 | TSHR (0.63) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL101601 | 0.77 | TSHR (0.63) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL31345289 | 0.76 | NR4A2 (0.45) | POLBNR4A2LMNATSHRALDH1A1 | |
| SCHEMBL699415 | 0.76 | LMNA (0.52) | POLBNR4A2LMNATSHRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2061754-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008115999-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2008-09-25 | — | — | WO | disclosed |