Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 8/20 | 0.37 |
| ▸ | KCNQ2 | O43526 | 8/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 5/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7865565 | 0.81 | L3MBTL1 (0.59) | KCNQ3KCNQ2LMNAKCNE1KCNQ1 | |
| SCHEMBL3824428 | 0.77 | KCNQ3 (0.42) | KCNQ3KCNQ2LMNAKCNE1KCNQ1 | |
| SCHEMBL9869934 | 0.74 | KCNQ3 (0.36) | KCNQ3KCNQ2LMNAKCNE1KCNQ1 | |
| SCHEMBL10584828 | 0.73 | KCNQ3 (0.40) | KCNQ3KCNQ2KCNE1KCNQ1SMN1; SMN2 | |
| SCHEMBL10590777 | 0.70 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1TP53HSP90AA1CYP3A4 | |
| SCHEMBL9220618 | 0.70 | STK17A (0.44) | KCNQ3KCNQ2KCNE1KCNQ1ALDH1A1 | |
| SCHEMBL6990978 | 0.70 | ALDH1A1 (0.47) | LMNAALDH1A1L3MBTL1TP53HSP90AA1 | |
| SCHEMBL132688 | 0.70 | TDP1 (0.52) | LMNAALDH1A1L3MBTL1TP53HSP90AA1 | |
| SCHEMBL12763802 | 0.69 | TNF (0.42) | KCNQ3KCNQ2KCNE1KCNQ1L3MBTL1 | |
| SCHEMBL9218436 | 0.68 | STK17A (0.51) | — |
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-1030317-C | Insecticidal composition using nitromethylene compound as active ingredient | SHELL INT RESEARCH (NL) | 1995-11-22 | — | — | CN | disclosed |
| EP-0369526-B1 | Nitromethylene compounds, their preparation and their use as pesticides | SHELL INT RESEARCH (NL) | 1995-07-26 | — | — | EP | disclosed |
| US-5039686-A | Insecticides | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1991-08-13 | — | — | US | disclosed |
| CN-1042710-A | Nitromethylene compounds, their preparation method and they are as the purposes of agricultural chemicals | SHELL INT RESEARCH (NL) | 1990-06-06 | — | — | CN | disclosed |
| EP-0369526-A2 | Nitromethylene compounds, their preparation and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-05-23 | — | — | EP | disclosed |