Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27513176 | 0.92 | ALDH1A1 (0.47) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL9293536 | 0.80 | ALDH1A1 (0.47) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL9293537 | 0.80 | ALDH1A1 (0.47) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL8762498 | 0.80 | ALDH1A1 (0.47) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL27533200 | 0.79 | TDP1 (0.49) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL27549918 | 0.78 | ALDH1A1 (0.52) | LMNACA12CA9PTPN1PTPRC | |
| SCHEMBL28918322 | 0.77 | PTPN1 (0.49) | LMNACA12CA9AKR1B10AKR1B1 | |
| SCHEMBL15910890 | 0.77 | LMNA (0.54) | LMNACA12CA9AKR1B10AKR1B1 | |
| SCHEMBL27514203 | 0.77 | PTPN1 (0.44) | LMNAPTPN1PTPRCALDH1A1TDP1 | |
| SCHEMBL7936677 | 0.75 | ALDH1A1 (0.53) | LMNACA12CA9ALDH1A1KDM4E |
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-109593068-B | Intermediate of ROR gamma inhibitor and preparation method thereof | 广东东阳光药业有限公司 | 2022-12-27 | — | — | CN | disclosed |