Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 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 | |
|---|---|---|---|---|
| SCHEMBL8556682 | 0.93 | RPS6KA2 (0.43) | RXRAELANECA2CA1CA9 | |
| SCHEMBL8557583 | 0.93 | RXRA (0.40) | RXRAELANECA2CA1CA9 | |
| SCHEMBL8556336 | 0.92 | RXRA (0.41) | RXRAELANECA2CA1CA9 | |
| SCHEMBL8557954 | 0.92 | RXRA (0.47) | RXRACA2CA1CA9CA12 | |
| SCHEMBL8559802 | 0.89 | RXRA (0.49) | RXRACA2CA1CA9CA12 | |
| SCHEMBL8560001 | 0.87 | RPS6KA2 (0.43) | RXRAELANECA2CA1CA9 | |
| SCHEMBL8555338 | 0.87 | RXRA (0.38) | RXRAELANECA2CA1CA9 | |
| SCHEMBL8560361 | 0.87 | RXRA (0.46) | RXRAELANESCN9AALDH1A1MAPT | |
| SCHEMBL8560978 | 0.85 | CDK9 (0.42) | RXRACA2CA1CA9CA12 | |
| SCHEMBL8559961 | 0.85 | RXRA (0.43) | RXRASCN9AALDH1A1MAPTADORA1 |
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 |