Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.61 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | SHBG | P04278 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | CLIC1 | O00299 | 1/20 | 0.47 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8285 | 1.00 | AKR1B1 (0.61) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| SCHEMBL29631318 | 1.00 | AKR1B1 (0.61) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| SCHEMBL28532359 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| Ammonia Solution, Strong SCHEMBL22042026 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| Water SCHEMBL30372687 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| Hydrochloric Acid SCHEMBL2527505 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| SCHEMBL30961703 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| Methyl Alcohol SCHEMBL9629191 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| SCHEMBL27701670 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD | |
| Ammonia Solution, Strong SCHEMBL27920751 | 0.98 | CTBP2 (0.59) | AKR1B1CTBP2PTGS2TDP1HPGD |
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-8039501-B2 | Synephrine derivatives useful as anti-inflammatory agents | UNIVERSITEIT GENT (BE) | 2011-10-18 | — | — | US | disclosed |