Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 4/20 | 0.38 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | CES1 | P23141 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL166910 | 0.86 | ALDH1A1 (0.43) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| Water SCHEMBL3826998 | 0.84 | ALDH1A1 (0.43) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL12918771 | 0.80 | ALDH1A1 (0.46) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL20907144 | 0.78 | HDAC4 (0.39) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL247694 | 0.77 | ALDH1A1 (0.56) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL1418707 | 0.77 | ALDH1A1 (0.56) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL8579752 | 0.76 | ALDH1A1 (0.39) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL24282367 | 0.75 | ACHE (0.38) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| Dimethylamine SCHEMBL1406822 | 0.75 | ALDH1A1 (0.42) | ALDH1A1NPSR1GLO1LMNAHSD17B10 | |
| SCHEMBL14194366 | 0.75 | GLO1 (0.38) | ALDH1A1NPSR1GLO1LMNAHSD17B10 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113651761-A | Synthesis method of bipyrazinyl bacteria amine precursor | 上海恩氟佳科技有限公司 | 2021-11-16 | — | — | CN | disclosed |
| EP-1054667-B1 | BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS | ASTRAZENECA UK LTD (GB) | 2003-04-16 | — | — | EP | disclosed |
| US-6291507-B1 | INHIBITOR OF MONOCYTE CHEMOATTRACTANT PROTEIN-1; INDOLE DERIVATIVES | ASTRAZENECA UK LIMITED (GB) | 2001-09-18 | — | — | US | disclosed |
| EP-1054667-A1 | BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS | AstraZeneca UK Limited (GB) | 2000-11-29 | — | — | EP | disclosed |
| WO-1999040913-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA UK LIMITED (GB) | 1999-08-19 | — | — | WO | disclosed |