Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | STS | P08842 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4069238 | 0.87 | MAPT (0.57) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| SCHEMBL17479477 | 0.80 | GSK3B (0.56) | KMT2ASMN1; SMN2 | |
| SCHEMBL22289601 | 0.80 | ALDH1A1 (0.48) | MAPTHPGDGAAKMT2ASMN1; SMN2 | |
| SCHEMBL28805020 | 0.75 | MAPT (0.52) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| SCHEMBL28668806 | 0.75 | MAPT (0.52) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| 4-Nitrophenyl Methylcarbamate SCHEMBL31417181 | 0.75 | MGLL (0.57) | MAPTRAB9ANPSR1GAAKMT2A | |
| SCHEMBL175551 | 0.74 | MAPT (0.67) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| SCHEMBL10355780 | 0.74 | MAPT (0.67) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| 4-(Acetate)Acetophenone SCHEMBL1142839 | 0.74 | MAPT (0.67) | MAPTRAB9AHPGDL3MBTL1NPSR1 | |
| SCHEMBL12893245 | 0.74 | ALDH1A1 (0.51) | MAPTRAB9AHPGDGAAKMT2A |
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-3180317-A1 | FACTOR XIa INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2017-06-21 | — | — | EP | disclosed |
| WO-2016015593-A1 | FACTOR XIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-02-04 | — | — | WO | disclosed |