Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 7/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5813978 | 0.83 | KDM4E (0.38) | KDM4EMAPTRAB9APTGS2ALDH1A1 | |
| SCHEMBL5817989 | 0.81 | NPC1 (0.34) | MEN1KMT2AKDM4EMAPTLMNA | |
| SCHEMBL5820441 | 0.74 | ALDH1A1 (0.34) | PTGS2ALDH1A1 | |
| SCHEMBL5816497 | 0.71 | PSD (0.39) | MEN1KMT2AKDM4EMAPTLMNA | |
| SCHEMBL5815540 | 0.65 | KDM4E (0.42) | MEN1KMT2AKDM4EMAPTLMNA | |
| SCHEMBL4751131 | 0.62 | KDM4C (0.38) | ADORA2AADORA1ADORA2BMEN1KMT2A | |
| SCHEMBL4795728 | 0.61 | MEN1 (0.34) | MEN1KMT2AKDM4EMAPTNPC1 | |
| SCHEMBL4795580 | 0.61 | MEN1 (0.36) | MEN1KMT2AKDM4EMAPTLMNA | |
| SCHEMBL1999851 | 0.59 | ADORA1 (0.46) | ADORA2AADORA1ADORA2BADORA3MAPK14 | |
| SCHEMBL29118710 | 0.58 | ADORA2A (0.49) | ADORA2AADORA1ADORA2BSMN1; SMN2ADORA3 |
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-2006112666-A1 | PYRIDINE DERIVATIVES, METHODS OF THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | SK CHEMICALS CO., LTD. (KR) | 2006-10-26 | — | — | WO | disclosed |