Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28329132 | 0.93 | SMN1; SMN2 (0.55) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL3406778 | 0.83 | KMT2A (0.61) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL7541382 | 0.76 | SMN1; SMN2 (0.92) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL14544487 | 0.74 | SMN1; SMN2 (0.63) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL26136014 | 0.73 | KMT2A (0.45) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL19692906 | 0.73 | HTR6 (0.41) | CA1CA2CA12CA9CYP3A4 | |
| SCHEMBL6386533 | 0.73 | KMT2A (0.67) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL7541872 | 0.72 | SMN1; SMN2 (1.00) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 | |
| SCHEMBL19692879 | 0.71 | L3MBTL1 (0.45) | ALDH1A1CA1CA2CA12CA9 | |
| SCHEMBL30140023 | 0.71 | KMT2A (0.42) | SMN1; SMN2KMT2AALDH1A1HPGDNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110483344-A | One kind sulfone compound of beta-hydroxy containing naphthenic base and its synthetic method | UNIV LIAONING SHIHUA | 2019-11-22 | — | — | CN | disclosed |