Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 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 | |
|---|---|---|---|---|
| SCHEMBL21352139 | 0.81 | MAPT (0.40) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL21362749 | 0.78 | TRPA1 (0.48) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL13761459 | 0.74 | ADRB2 (0.45) | TDP1SMN1; SMN2LMNAPTGS2MEN1 | |
| SCHEMBL21362664 | 0.73 | ABL1 (0.37) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL21362647 | 0.72 | F2RL1 (0.40) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL20157481 | 0.72 | TOP2A (0.39) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL20158035 | 0.71 | ABL1 (0.36) | ABL1RIN1L3MBTL1MAPTHPGD | |
| SCHEMBL12806458 | 0.71 | PTGS2 (0.48) | PTGS2 | |
| SCHEMBL13698783 | 0.70 | PTGS2 (0.52) | MAPTSMN1; SMN2LMNAPTGS2KMT2A | |
| SCHEMBL21550075 | 0.70 | MAPT (0.40) | ABL1RIN1L3MBTL1MAPTHPGD |
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 |