Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.31 |
| ▸ | ATF1 | P18846 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17773678 | 0.75 | ALDH1A1 (0.41) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL15633724 | 0.74 | ALDH1A1 (0.40) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL22119896 | 0.72 | ALDH1A1 (0.41) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL27053741 | 0.72 | PIN1 (0.42) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL28192509 | 0.71 | ALDH1A1 (0.40) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL28328264 | 0.70 | PIN1 (0.36) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL17773677 | 0.69 | NFKB1 (0.44) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL30962568 | 0.65 | NNMT (0.46) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL23518895 | 0.65 | LMNA (0.39) | ALDH1A1KDM4ESMN1; SMN2HDAC6 | |
| SCHEMBL15614460 | 0.65 | ALDH1A1 (0.43) | PIN1ALDH1A1GAAKDM4ESMN1; SMN2 |
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-116829550-A | Pyrimidine-2-ylsulfonamide derivatives | 豪夫迈·罗氏有限公司 | 2023-09-29 | — | — | CN | disclosed |