Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HTR1E | P28566 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29065876 | 0.88 | LMNA (0.52) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL29065898 | 0.88 | LMNA (0.47) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL29065886 | 0.87 | S1PR1 (0.47) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL29065882 | 0.84 | LMNA (0.42) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL29065874 | 0.83 | RAB9A (0.44) | CA1LMNASMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL29065864 | 0.81 | CA1 (0.61) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL29065875 | 0.80 | CA1 (0.82) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL28015291 | 0.78 | CA1 (0.82) | CA1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL6818965 | 0.73 | SLC6A9 (0.62) | LMNAMAPTALDH1A1MEN1MAPK1 | |
| SCHEMBL16375340 | 0.72 | CA1 (1.00) | CA1LMNASMN1; SMN2MAPTHPGD |
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-116715596-A | Method for synthesizing beta-aminoketone compound by synergistic catalysis of cyclopentadienyl titanium/Bronsted acid | 宁夏师范学院 | 2023-09-08 | — | — | CN | disclosed |