Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL19712296 | 0.89 | CA1 (0.41) | CA1CA2CYP3A4ALDH1A1HPGD | |
| Naphthalene SCHEMBL368789 | 0.89 | CA1 (0.41) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL27642594 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL27642281 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL27642275 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL7712 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL17685497 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL29376031 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL29555130 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD | |
| SCHEMBL7432807 | 0.89 | TSHR (0.43) | CA1CA2CYP3A4ALDH1A1HPGD |
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-106574121-B | Plastic-coated mercaptosilane/wax mixtures | 赢创运营有限公司 | 2020-04-07 | — | — | CN | disclosed |
| CN-104395350-A | System and method for managing waste associated with processing of guayule shrubs to extract rubber | BRIDGESTONE CORP | 2015-03-04 | — | — | CN | disclosed |