Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 5/20 | 0.45 |
| ▸ | ACE | P12821 | 3/20 | 0.45 |
| ▸ | ECE1 | P42892 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CPA1 | P15085 | 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 | |
|---|---|---|---|---|
| SCHEMBL27922237 | 1.00 | PTGS1 (0.51) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL213625 | 0.98 | PTGS1 (0.53) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL27574429 | 0.98 | PTGS1 (0.53) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL11766266 | 0.98 | PTGS1 (0.53) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL213626 | 0.98 | PTGS1 (0.53) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL3393046 | 0.92 | ALDH1A1 (0.52) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| SCHEMBL3393040 | 0.92 | ALDH1A1 (0.52) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| Cysteine SCHEMBL6014792 | 0.92 | PTGS1 (0.61) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| Cysteine SCHEMBL6014796 | 0.92 | PTGS1 (0.61) | PTGS1GSTK1ALDH1A1MAPTLMNA | |
| Glycine SCHEMBL28155782 | 0.92 | PTGS1 (0.49) | PTGS1GSTK1ALDH1A1MAPTLMNA |
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-103380108-A | Palladium-copper catalyst for homogeneous selective oxidation of thiol groups | IVY PHARM LTD LIABILITY COMPANY | 2013-10-30 | — | — | CN | disclosed |