Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CCR9 | P51686 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157971 | 0.80 | NPC1 (0.44) | MAPTLMNAHTTTP53KMT2A | |
| SCHEMBL28469745 | 0.79 | KMT2A (0.47) | MAPTKMT2AHPGDALDH1A1KDM4E | |
| SCHEMBL20157980 | 0.78 | LMNA (0.38) | MAPTLMNAHTTTP53KMT2A | |
| SCHEMBL20157997 | 0.77 | MAPT (0.40) | MAPTLMNAHTTTP53KMT2A | |
| SCHEMBL20157667 | 0.77 | MAPT (0.43) | MAPTLMNAHTTTP53KMT2A | |
| SCHEMBL20157705 | 0.76 | MAPT (0.49) | MAPTLMNAHTTALDH1A1L3MBTL1 | |
| SCHEMBL20157995 | 0.74 | MAPT (0.44) | MAPTLMNAHTTALDH1A1CA12 | |
| SCHEMBL20157982 | 0.74 | LCK (0.39) | MAPTLMNAHTTTP53HPGD | |
| SCHEMBL20157492 | 0.73 | MAPT (0.57) | MAPTLMNAHTTHPGDALDH1A1 | |
| SCHEMBL21362817 | 0.72 | HPGD (0.39) | MAPTLMNAHPGDALDH1A1KDM4E |
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-2018086605-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |