Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9766076 | 0.96 | TSHR (0.52) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL8593844 | 0.94 | TSHR (0.46) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL9766080 | 0.88 | TSHR (0.44) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL1719721 | 0.87 | TSHR (0.59) | TSHRMAPK1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL8653304 | 0.86 | KMT2A (0.50) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL7198377 | 0.84 | TSHR (0.57) | TSHRMAPK1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL522175 | 0.84 | TSHR (0.61) | TSHRMAPK1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL27388705 | 0.84 | MEN1 (0.41) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL27866508 | 0.84 | TSHR (0.46) | TSHRMAPK1KMT2AMEN1CYP2C9 | |
| SCHEMBL27387387 | 0.84 | PTPN1 (0.44) | TSHRMAPK1KMT2AMEN1CYP2C9 |
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-1064955-C | Fluorine-containing benzoylguanidines | MERCK PATENT GMBH (DE) | 2001-04-25 | — | — | CN | disclosed |
| CN-1143632-A | Fluorine-containing benzoylguanidines | MERCK PATENT GMBH (DE) | 1997-02-26 | — | — | CN | disclosed |