Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.77 |
| ▸ | MEN1 | O00255 | 2/20 | 0.77 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.69 |
| ▸ | CA2 | P00918 | 3/20 | 0.65 |
| ▸ | MMP2 | P08253 | 2/20 | 0.65 |
| ▸ | CA1 | P00915 | 1/20 | 0.65 |
| ▸ | MMP1 | P03956 | 1/20 | 0.65 |
| ▸ | MMP9 | P14780 | 1/20 | 0.65 |
| ▸ | MMP8 | P22894 | 1/20 | 0.65 |
| ▸ | MMP13 | P45452 | 1/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA5A | P35218 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | F2 | P00734 | 1/20 | 0.56 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.56 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL27625297 | 0.88 | KMT2A (0.83) | KMT2AMEN1CYP19A1CA2MMP2 | |
| Dinsed SCHEMBL1814194 | 0.87 | KMT2A (1.00) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL922441 | 0.84 | KMT2A (0.77) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL31470272 | 0.84 | KMT2A (0.71) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL7508872 | 0.82 | KMT2A (0.64) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL3025870 | 0.82 | KMT2A (0.83) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL6302342 | 0.82 | CYP19A1 (0.59) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL13590904 | 0.82 | CA2 (0.75) | KMT2AMEN1CYP19A1CA2MMP2 | |
| Diethylamine SCHEMBL4005834 | 0.81 | KMT2A (0.71) | KMT2AMEN1CYP19A1CA2MMP2 | |
| SCHEMBL7681888 | 0.81 | KMT2A (0.71) | KMT2AMEN1CYP19A1CA2MMP2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113024514-B | Aminodithioformate compound, preparation method thereof, pharmaceutical composition and application thereof | 北京大学 | 2022-02-15 | — | — | CN | claimed |
| CN-113024514-A | Aminodithioformate compound, preparation method thereof, pharmaceutical composition and application thereof | 北京大学 | 2021-06-25 | — | — | CN | claimed |
| CN-113024514-B | Aminodithioformate compound, preparation method thereof, pharmaceutical composition and application thereof | 北京大学 | 2022-02-15 | — | — | CN | disclosed |
| CN-113024514-A | Aminodithioformate compound, preparation method thereof, pharmaceutical composition and application thereof | 北京大学 | 2021-06-25 | — | — | CN | disclosed |
| EP-1713483-A1 | CHEMOKINE INHIBITING PIPERAZINE DERIVATIVES AND THEIR USE TO TREAT MULTIPLE MYELOMA | Schering Aktiengesellschaft (DE) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005077372-A1 | CHEMOKINE INHIBITING PIPERAZINE DERIVATIVES AND THEIR USE TO TREAT MULTIPLE MYELOMA | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-08-25 | — | — | WO | disclosed |