Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | DNM2 | P50570 | 6/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13309894 | 0.86 | PFKFB3 (0.55) | PFKFB3TLR8ALDH1A1TSHRCYP3A4 | |
| SCHEMBL13309897 | 0.82 | PFKFB3 (0.44) | ESR1PFKFB3TLR8ALDH1A1TSHR | |
| SCHEMBL13309896 | 0.80 | PFKFB3 (0.43) | PFKFB3TLR8ALDH1A1TSHRCYP3A4 | |
| SCHEMBL13309895 | 0.78 | PFKFB3 (0.48) | PFKFB3TLR8ALDH1A1TSHRCYP3A4 | |
| SCHEMBL13309890 | 0.78 | ABCG2 (0.49) | PFKFB3ALDH1A1TSHRNPY5RHTT | |
| SCHEMBL9589620 | 0.77 | TLR8 (0.66) | ESR1TLR8ALDH1A1TSHRHTT | |
| SCHEMBL13309893 | 0.77 | PFKFB3 (0.45) | PFKFB3TLR8ALDH1A1TSHRCYP3A4 | |
| SCHEMBL6926880 | 0.76 | ALDH1A1 (0.48) | PFKFB3ALDH1A1TSHRCYP3A4NPY5R | |
| SCHEMBL3407268 | 0.76 | ESR1 (0.79) | ESR1ALDH1A1MAPTKMT2AL3MBTL1 | |
| SCHEMBL13309898 | 0.75 | PFKFB3 (0.46) | PFKFB3TLR8ALDH1A1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-3932408-A | PESTICIDES, HERBICIDES, FUNGICIDES | WACKER-CHEMIE GMBH (DT) | 1976-01-13 | — | — | US | disclosed |