Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 5/20 | 0.38 |
| ▸ | STS | P08842 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.36 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29284908 | 1.00 | ALDH1A1 (0.41) | ALDH1A1CYP3A4KDM4EPOLBTSHR | |
| SCHEMBL30951231 | 0.81 | ESPL1 (0.39) | ALDH1A1MAPK1VCAM1STSCYP19A1 | |
| SCHEMBL29284988 | 0.81 | ESPL1 (0.39) | ALDH1A1MAPK1VCAM1STSCYP19A1 | |
| SCHEMBL30957286 | 0.78 | ATM (0.39) | ALDH1A1MAPK1VCAM1STSCYP19A1 | |
| SCHEMBL30686717 | 0.77 | HTR2A (0.43) | CYP19A1 | |
| SCHEMBL9251756 | 0.77 | HTR2A (0.43) | CYP19A1 | |
| SCHEMBL7219649 | 0.75 | FABP4 (0.39) | ALDH1A1CYP3A4TSHRMAPK1VCAM1 | |
| SCHEMBL6616312 | 0.71 | HSP90AA1 (0.49) | ALDH1A1MAPTCA1CA2MEN1 | |
| SCHEMBL18339371 | 0.71 | HSP90AA1 (0.49) | ALDH1A1MAPTCA1CA2MEN1 | |
| SCHEMBL18340274 | 0.71 | HSP90AA1 (0.49) | ALDH1A1MAPTCA1CA2MEN1 |
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-118251393-A | Novel substituted sulfonylurea compounds as inhibitors of interleukin-1 activity | 唯久生物技术(苏州)有限公司 | 2024-06-25 | — | — | CN | disclosed |