Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4682432 | 0.84 | HPGD (0.72) | HPGDLMNATRPA1ALDH1A1MAPT | |
| SCHEMBL4682438 | 0.82 | HPGD (0.70) | HPGDLMNATRPA1ALDH1A1MEN1 | |
| SCHEMBL1242290 | 0.82 | HPGD (0.70) | HPGDLMNATRPA1ALDH1A1KMT2A | |
| SCHEMBL4679490 | 0.82 | HPGD (1.00) | HPGDLMNATRPA1ALDH1A1MEN1 | |
| SCHEMBL4679419 | 0.81 | HPGD (0.69) | HPGDLMNATRPA1ALDH1A1MEN1 | |
| SCHEMBL10805990 | 0.79 | HPGD (0.65) | HPGDLMNAALDH1A1MEN1KMT2A | |
| Chloral Hydrate SCHEMBL6624035 | 0.79 | HPGD (0.65) | HPGDLMNATRPA1ALDH1A1MEN1 | |
| SCHEMBL10811292 | 0.70 | CYP3A4 (0.59) | HPGDLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL10705725 | 0.69 | HPGD (0.53) | HPGDLMNAMEN1KMT2A | |
| SCHEMBL11604284 | 0.68 | KDM4E (0.54) | HPGDLMNATRPA1ALDH1A1MAPT |
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-2011019681-A1 | SELECTIVE SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS | ALLERGAN, INC. (US) | 2011-02-17 | — | — | WO | disclosed |