Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | BRD2 | P25440 | 1/20 | 0.42 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.42 |
| ▸ | IDH2 | P48735 | 1/20 | 0.41 |
| ▸ | PARG | Q86W56 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5849863 | 0.88 | ALDH1A1 (0.53) | ALDH1A1CYP3A4TSHRPKMKDM4E | |
| SCHEMBL5848446 | 0.83 | MAPK1 (0.42) | PKMBRD4BRD2BRD3PARG | |
| SCHEMBL5848834 | 0.83 | PKM (0.42) | LMNATSHRPKMBRD4BRD2 | |
| SCHEMBL5849888 | 0.82 | MMP1 (0.41) | PKMBRD4PARGHTR1AHTR7 | |
| SCHEMBL5848641 | 0.81 | MAP2K4 (0.48) | PKMIDH2HTR1AHTR7KDM4E | |
| SCHEMBL5849713 | 0.81 | PKM (0.46) | PKMPARGHTR1AHTR7KDM4E | |
| SCHEMBL12418316 | 0.76 | PIK3CD (0.51) | LMNAALDH1A1CYP3A4TSHRBRD4 | |
| SCHEMBL11992039 | 0.71 | ALDH1A1 (0.63) | LMNAALDH1A1CYP3A4TSHRBRD4 | |
| SCHEMBL15646282 | 0.70 | IDH2 (0.54) | LMNAALDH1A1CYP3A4TSHRBRD4 | |
| SCHEMBL28713447 | 0.68 | SMN1; SMN2 (0.63) | LMNAALDH1A1CYP3A4TSHRPKM |
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 |
|---|---|---|---|---|---|---|---|
| US-7112605-B2 | Sulfonyl-containing 3,4-diaryl-3-pyrrolin-2-ones, preparation method, and medical use thereof | Research Institute of Materia Medica Chinese Acadamy of Medical Sciences (CN) | 2006-09-26 | — | — | US | claimed |