Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL1834206 | 1.00 | NCEH1 (0.43) | NCEH1PTPN1KMT2AMEN1POLB | |
| SCHEMBL729665 | 0.83 | NCEH1 (0.46) | NCEH1PTPN1KMT2APOLBALDH1A1 | |
| SCHEMBL29580838 | 0.83 | NCEH1 (0.46) | NCEH1PTPN1KMT2APOLBALDH1A1 | |
| SCHEMBL473084 | 0.82 | POLB (0.56) | KMT2AMEN1POLBALDH1A1MAPT | |
| SCHEMBL31498232 | 0.82 | POLB (0.56) | KMT2AMEN1POLBALDH1A1MAPT | |
| SCHEMBL6973179 | 0.81 | NCEH1 (0.44) | NCEH1PTPN1KMT2APOLBALDH1A1 | |
| SCHEMBL6269458 | 0.81 | PTPN1 (0.57) | NCEH1PTPN1KMT2APOLBALDH1A1 | |
| SCHEMBL983662 | 0.81 | PTPN1 (0.45) | NCEH1PTPN1KMT2AMEN1POLB | |
| SCHEMBL5666918 | 0.78 | NCEH1 (0.34) | NCEH1PTPN1KMT2AMEN1KDM4E | |
| SCHEMBL5665552 | 0.78 | NCEH1 (0.37) | NCEH1PTPN1KMT2AMEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023080257-A1 | METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION | 旭化成株式会社 | 2023-05-11 | — | — | WO | disclosed |