Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GSR | P00390 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ACP3 | P15309 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8510918 | 0.89 | LMNA (0.46) | LMNATSHRKDM4EMAPTKMT2A | |
| SCHEMBL146897 | 0.89 | LMNA (0.46) | LMNATSHRKDM4EMAPTKMT2A | |
| Fluoride SCHEMBL27406526 | 0.87 | LMNA (0.44) | LMNATSHRKDM4EMAPTKMT2A | |
| SCHEMBL28375294 | 0.87 | LMNA (0.44) | LMNATSHRKDM4EMAPTKMT2A | |
| SCHEMBL29623050 | 0.87 | LMNA (0.44) | LMNATSHRKDM4EMAPTKMT2A | |
| SCHEMBL11696138 | 0.87 | LMNA (0.44) | LMNATSHRKDM4EMAPTKMT2A | |
| SCHEMBL29740132 | 0.85 | LMNA (0.42) | LMNATSHRKDM4EMAPTKMT2A | |
| Alcohol SCHEMBL28394492 | 0.82 | GSR (0.49) | LMNAKDM4EMAPTKMT2ANPSR1 | |
| SCHEMBL11290493 | 0.82 | ACHE (0.52) | LMNAACHETSHRMAPTKMT2A | |
| Toluene SCHEMBL27929648 | 0.80 | LMNA (0.42) | LMNAACHETSHRALOX12KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-108997137-A | The method for preparing toluenediamine by catalytic hydrogenation dinitrotoluene (DNT) | 麻城市天恒商贸有限公司 | 2018-12-14 | — | — | CN | disclosed |