Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 2/20 | 0.47 |
| ▸ | CTSA | P10619 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL5142203 | 0.80 | IDO1 (0.44) | CDK2CTSAALDH1A1GPBAR1LMNA | |
| Iodobenzene SCHEMBL20985741 | 0.79 | CDK2 (0.50) | TSHRCDK2CTSAALDH1A1GRM5 | |
| SCHEMBL138054 | 0.79 | — | — | |
| SCHEMBL238833 | 0.72 | — | — | |
| SCHEMBL30899418 | 0.70 | — | — | |
| O-Xylene SCHEMBL27638879 | 0.70 | TSHR (0.71) | ACHETSHRALDH1A1CYP2A6LMNA | |
| O-Xylene SCHEMBL6933035 | 0.69 | TSHR (0.83) | ACHETSHRALDH1A1CYP2A6LMNA | |
| O-Xylene SCHEMBL170581 | 0.69 | TSHR (1.00) | ACHETSHRALDH1A1CYP2A6LMNA | |
| O-Xylene SCHEMBL10522915 | 0.69 | TSHR (1.00) | ACHETSHRALDH1A1CYP2A6LMNA | |
| O-Xylene SCHEMBL11034038 | 0.69 | TSHR (1.00) | ACHETSHRALDH1A1CYP2A6LMNA |
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-100558715-C | Kinases inhibitor | CYTOPIA PTY LTD (AU) | 2009-11-11 | — | — | CN | disclosed |
| CN-1656082-A | Protein kinase inhibitors | CYTOPIA PTY LTD (AU) | 2005-08-17 | — | — | CN | disclosed |