Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 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 | |
|---|---|---|---|---|
| SCHEMBL21962368 | 0.79 | MAPT (0.47) | ALDH1A1CYP1A2CA2CA12CA1 | |
| SCHEMBL31475656 | 0.79 | MAPT (0.47) | ALDH1A1CYP1A2CA2CA12CA1 | |
| SCHEMBL19623129 | 0.74 | ALDH1A1 (0.49) | ALDH1A1TSHRCYP1A2L3MBTL1LMNA | |
| SCHEMBL3465738 | 0.72 | PIM1 (0.47) | ALDH1A1TSHRCNR2CA2CA12 | |
| SCHEMBL27101915 | 0.70 | ALDH1A1 (0.59) | ALDH1A1TSHRL3MBTL1LMNANPC1 | |
| SCHEMBL20188582 | 0.69 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP1A2L3MBTL1LMNA | |
| SCHEMBL161503 | 0.69 | ALDH1A1 (0.45) | ALDH1A1TSHRCYP1A2L3MBTL1LMNA | |
| SCHEMBL30817753 | 0.69 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP1A2L3MBTL1LMNA | |
| SCHEMBL14767681 | 0.69 | CA12 (0.63) | ALDH1A1TSHRCA2CA12CA1 | |
| SCHEMBL164480 | 0.68 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP1A2L3MBTL1LMNA |
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-2020102096-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |
| WO-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |