Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3595414 | 0.98 | TDP1 (0.54) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL9016901 | 0.96 | DNM1 (0.65) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL16790267 | 0.91 | DNM1 (0.64) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL18402526 | 0.91 | DNM1 (0.71) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL18871738 | 0.91 | DNM1 (0.71) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL24511377 | 0.91 | DNM1 (0.64) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL1757113 | 0.90 | TDP1 (0.62) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL6747424 | 0.90 | ALDH1A1 (0.65) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL759749 | 0.90 | ALDH1A1 (0.65) | DNM1ALDH1A1TSHRTDP1PAOX | |
| SCHEMBL758147 | 0.90 | ALDH1A1 (0.65) | DNM1ALDH1A1TSHRTDP1PAOX |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107636464-A | The removing toxic substances of microorganism virulence factor in oral cavity | 宝洁公司 | 2018-01-26 | — | — | CN | claimed |
| CN-107636464-A | The removing toxic substances of microorganism virulence factor in oral cavity | 宝洁公司 | 2018-01-26 | — | — | CN | disclosed |