Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Dichloroxylenol SCHEMBL29367847 | 0.97 | ALDH1A1 (0.61) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| Dichloroxylenol SCHEMBL574277 | 0.97 | ALDH1A1 (0.61) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL28623712 | 0.84 | HPGD (0.46) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL8650668 | 0.82 | ALDH1A1 (0.61) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL10820980 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| Dichloroxylenol SCHEMBL6915423 | 0.80 | ALDH1A1 (0.46) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL1286188 | 0.80 | MAPT (0.48) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL242037 | 0.80 | MAPT (0.59) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL28732224 | 0.79 | CYP3A4 (0.55) | ALDH1A1MAPTGAACYP3A4ALOX15 | |
| SCHEMBL1003476 | 0.78 | CYP3A4 (0.50) | ALDH1A1MAPTGAACYP3A4ALOX15 |
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-105198029-A | Extraction treatment method for 2, 4-dichloro-3, 5-dimethylphenol waste water | UNIV HUNAN | 2015-12-30 | — | — | CN | claimed |
| CN-105198029-A | Extraction treatment method for 2, 4-dichloro-3, 5-dimethylphenol waste water | UNIV HUNAN | 2015-12-30 | — | — | CN | disclosed |