Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | BRAF | P15056 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29450610 | 0.87 | KMT2A (0.67) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL29450605 | 0.85 | ALDH1A1 (0.64) | KMT2ASMN1; SMN2MEN1HTTRAB9A | |
| SCHEMBL29450609 | 0.85 | NPC1 (0.58) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL29450622 | 0.83 | KMT2A (0.54) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL29450611 | 0.81 | EPHX1 (0.67) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL16982851 | 0.80 | KMT2A (0.56) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL31224439 | 0.80 | KMT2A (0.56) | POLBKMT2ASMN1; SMN2MEN1HTT | |
| SCHEMBL6439308 | 0.79 | KMT2A (1.00) | KMT2ASMN1; SMN2MEN1HTTRAB9A | |
| SCHEMBL29450606 | 0.79 | KMT2A (0.65) | KMT2ASMN1; SMN2MEN1HTTRAB9A | |
| SCHEMBL29450631 | 0.76 | HCRTR2 (0.49) | SMN1; SMN2HTTHCRTR2ALDH1A1CYP3A4 |
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-2022030589-A1 | LIGAND CONTAINING MONODENTATE COORDINATION UREA COMPOUND, AND BORYLATION CATALYST CONTAINING SAME | 国立大学法人北海道大学 | 2022-02-10 | — | — | WO | disclosed |