Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.33 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.33 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.33 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.33 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.33 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6338574 | 0.88 | HTR2A (0.36) | CYP1A2CYP2C19ALDH1A1CYP2D6HSD17B10 | |
| SCHEMBL7200121 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6340584 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL6332586 | 0.80 | CA1 (0.34) | ALDH1A1TSHRMAPTNPSR1GAA | |
| Hydrochloric Acid SCHEMBL6330160 | 0.77 | CYP1A2 (0.36) | CYP1A2CYP2C19CYP2C9ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL6332922 | 0.76 | — | — | |
| SCHEMBL10787315 | 0.72 | ALDH1A1 (0.58) | CYP1A2CYP2C19CYP2C9ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL6338571 | 0.72 | ALDH1A1 (0.36) | CYP1A2CYP2C19ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL9579880 | 0.70 | CYP1A2 (0.53) | CYP1A2CYP2C19CYP2C9ALDH1A1KDM4E | |
| SCHEMBL11133824 | 0.68 | ALDH1A1 (0.60) | CYP1A2CYP2C19CYP2C9ALDH1A1KDM4E |
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-20030171212-A1 | Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer | SUMITOMO CHEMICAL COMPANY, LIMITED | 2003-09-11 | — | — | US | disclosed |