Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSF1R | P07333 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15079442 | 0.90 | CYP2C19 (0.52) | CYP2C19PYCR1NR1H2NR1H3ALDH1A1 | |
| SCHEMBL4402952 | 0.90 | CYP2C19 (0.52) | CYP2C19PYCR1NR1H2NR1H3ALDH1A1 | |
| SCHEMBL31374882 | 0.85 | NR1H2 (0.57) | CSF1REGFRCYP2C19NR1H2NR1H3 | |
| SCHEMBL12679046 | 0.84 | ALDH1A1 (0.52) | CYP2C19PYCR1NR1H2NR1H3ALDH1A1 | |
| SCHEMBL12679026 | 0.84 | HRH3 (0.52) | CYP2C19PYCR1NR1H2NR1H3ALDH1A1 | |
| SCHEMBL14549464 | 0.83 | ALDH1A1 (0.40) | CSF1REGFRCYP2C19ALDH1A1TSHR | |
| SCHEMBL5403123 | 0.82 | CRHBP (0.57) | CSF1REGFRNR1H2NR1H3ALDH1A1 | |
| Trimethylammonium SCHEMBL9858163 | 0.81 | IDO1 (0.46) | CSF1REGFRPYCR1ALDH1A1TSHR | |
| SCHEMBL8228982 | 0.80 | CYP2C19 (0.68) | CYP2C19NR1H2NR1H3ALDH1A1TSHR | |
| SCHEMBL11001060 | 0.80 | CRHBP (0.59) | CYP2C19PYCR1NR1H2NR1H3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009109999-A1 | NOVEL PROTEIN TYROSINE PHOSPHATASE - IB INHIBITORS | LUPIN LIMITED (IN) | 2009-09-11 | — | — | WO | disclosed |