Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.46 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11830726 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TDP1ADAMTS4HRH2HRH1 | |
| SCHEMBL11834575 | 0.81 | GSK3B (0.39) | PTGS2AKR1C3AKR1C2SOAT1 | |
| SCHEMBL11672909 | 0.78 | ALDH1A1 (0.60) | ALDH1A1TDP1ADAMTS4CYP1A2PTGS2 | |
| SCHEMBL11842086 | 0.74 | MMP2 (0.44) | PTGS2MAPTMEN1CYP2D6CYP2C9 | |
| SCHEMBL11842494 | 0.73 | ALDH1A1 (0.62) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL11790626 | 0.72 | ALDH1A1 (0.60) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL11835910 | 0.71 | ADAMTS4 (0.55) | ALDH1A1TDP1ADAMTS4HRH2HRH1 | |
| SCHEMBL11841875 | 0.71 | ALDH1A1 (0.41) | ALDH1A1CYP1A2PTGS2TSHRMAPT | |
| SCHEMBL11757234 | 0.71 | ALDH1A1 (0.54) | ALDH1A1TDP1ADAMTS4HRH2HRH1 | |
| SCHEMBL11840794 | 0.71 | CYP2A6 (0.41) | ALDH1A1TDP1PTGS2MAPTMEN1 |
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-3941821-A | ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS | WILLIAM H. RORER, INC. (US) | 1976-03-02 | — | — | US | disclosed |