Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 6/20 | 0.39 |
| ▸ | ICMT | O60725 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 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 | |
|---|---|---|---|---|
| SCHEMBL12984764 | 1.00 | HDAC1 (0.40) | HDAC1HDAC8RORCDPP4ICMT | |
| SCHEMBL28217637 | 0.84 | HDAC1 (0.41) | HDAC1HDAC8DPP4CA2MMP1 | |
| SCHEMBL24575335 | 0.84 | KDM1A (0.38) | HDAC1HDAC8RORCICMTHTT | |
| SCHEMBL4314806 | 0.84 | KIF11 (0.36) | HDAC1HDAC8RORCICMTHTT | |
| SCHEMBL28181253 | 0.84 | HDAC1 (0.40) | HDAC1HDAC8RORCDPP4MMP1 | |
| SCHEMBL16005219 | 0.81 | DGAT1 (0.36) | HDAC1HDAC8RORCICMTHTT | |
| SCHEMBL29718812 | 0.81 | ICMT (0.44) | ICMT | |
| SCHEMBL28687813 | 0.79 | HDAC1 (0.37) | HDAC1HDAC8RORCDPP4MMP1 | |
| SCHEMBL332576 | 0.79 | CXCL8 (0.43) | HDAC1HDAC8DPP4MMP1MMP2 | |
| SCHEMBL29362137 | 0.79 | CXCL8 (0.43) | HDAC1HDAC8DPP4MMP1MMP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114957137-B | N- (1, 2,3, 6-tetrahydropyrimidine-4-yl) -2-phenylacetamide compound and preparation and application thereof | 沈阳药科大学 | 2023-10-27 | — | — | CN | disclosed |
| CN-114957137-A | N- (1,2,3, 6-tetrahydropyrimidine-4-yl) -2-phenyl acetamide compound and preparation and application thereof | 沈阳药科大学 | 2022-08-30 | — | — | CN | disclosed |