Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.34 |
| ▸ | RXRA | P19793 | 2/20 | 0.34 |
| ▸ | RXRB | P28702 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555727 | 0.93 | PTGS1 (0.43) | PTGS1PTGS2CA12CA1CA2 | |
| SCHEMBL8559346 | 0.84 | NR4A2 (0.48) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8555152 | 0.84 | SCN9A (0.40) | CA2CA9ALDH1A1HPGD | |
| SCHEMBL8557473 | 0.83 | NR4A2 (0.44) | PTGS1PTGS2ALDH1A1MAPTLMNA | |
| SCHEMBL7501908 | 0.83 | PTGS2 (0.54) | PTGS1PTGS2CA12CA1CA2 | |
| SCHEMBL8560340 | 0.83 | RXRA (0.46) | PTGS1PTGS2ALDH1A1MAPTLMNA | |
| SCHEMBL8560396 | 0.83 | NR4A2 (0.40) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8557401 | 0.82 | NR4A2 (0.46) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8556041 | 0.82 | RXRA (0.47) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8556639 | 0.80 | FAAH (0.36) | CA12CA1CA2CA9ALDH1A1 |
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-5719163-A | ARTHRITIS | G.D. SEARLE & CO. (US) | 1998-02-17 | — | — | US | disclosed |