Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL5028318 | 0.84 | ACHE (0.59) | MAPTNPSR1L3MBTL1POLBACHE | |
| Hydrochloric Acid SCHEMBL8706033 | 0.81 | ACHE (0.56) | MAPTNPSR1L3MBTL1POLBACHE | |
| SCHEMBL5946197 | 0.80 | MAPT (0.57) | MAPTNPSR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL7479301 | 0.80 | MAPT (0.57) | MAPTNPSR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL31211203 | 0.80 | MAPT (0.57) | MAPTNPSR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL348577 | 0.78 | MAPT (0.58) | MAPTNPSR1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL1126364 | 0.77 | ACHE (0.52) | MAPTNPSR1L3MBTL1POLBACHE | |
| SCHEMBL4730926 | 0.77 | ALDH1A1 (0.56) | MAPTNPSR1L3MBTL1POLBACHE | |
| SCHEMBL30436671 | 0.77 | ACHE (0.52) | MAPTNPSR1L3MBTL1POLBACHE | |
| SCHEMBL11139031 | 0.77 | ACHE (0.52) | MAPTNPSR1L3MBTL1POLBACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020015744-A1 | AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR | 南京明德新药研发有限公司 | 2020-01-23 | — | — | WO | disclosed |
| US-8791267-B2 | Biaryl PDE4 inhibitors for treating inflammatory, cardiovascular and CNS disorders | DECODE GENETICS EHF (IS) | 2014-07-29 | — | — | US | disclosed |