Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.53 |
| ▸ | AR | P10275 | 2/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.53 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28212030 | 0.88 | MAPK14 (0.55) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL31098999 | 0.85 | KMT2A (0.65) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28088011 | 0.85 | LMNA (0.58) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28088149 | 0.85 | TNKS (0.49) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28088260 | 0.82 | CYP3A4 (0.54) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28088009 | 0.81 | ABCG2 (0.64) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28195347 | 0.79 | CYP3A4 (0.53) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL592430 | 0.77 | CA1 (0.55) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL28139718 | 0.76 | ELANE (0.44) | KMT2AMEN1CYP3A4CA1CA2 | |
| SCHEMBL13955890 | 0.75 | CYP3A4 (0.53) | KMT2AMEN1CYP3A4CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105837539-B | Method for substituting 2-site aryl for 3-site fluoro of benzofuran ring | 复旦大学 | 2018-11-13 | — | — | CN | disclosed |
| CN-105837539-A | Method for substituting 2-site aryl for 3-site fluoro of benzofuran ring | 复旦大学 | 2016-08-10 | — | — | CN | disclosed |