Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.32 |
| ▸ | MYLK | Q15746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | PRKCG | P05129 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10883526 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TDP1RECQLALOX15CYP3A4 | |
| SCHEMBL19899827 | 0.76 | MAPT (0.44) | ALDH1A1TDP1RECQLCYP3A4LMNA | |
| SCHEMBL108757 | 0.76 | MAPT (0.44) | ALDH1A1TDP1RECQLCYP3A4LMNA | |
| SCHEMBL29354986 | 0.76 | MAPT (0.44) | ALDH1A1TDP1RECQLCYP3A4LMNA | |
| SCHEMBL10248422 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CYP3A4GAAKDM4EHPGD | |
| Hydrochloric Acid SCHEMBL552122 | 0.75 | ALDH1A1 (0.38) | ALDH1A1CYP3A4GAAKDM4EHPGD | |
| SCHEMBL8099008 | 0.75 | HSD17B3 (0.44) | ALDH1A1TDP1RECQLALOX15CYP3A4 | |
| Hydrochloric Acid SCHEMBL7132484 | 0.75 | MAPT (0.42) | ALDH1A1TDP1RECQLCYP3A4THRB | |
| Hydrochloric Acid SCHEMBL6256039 | 0.75 | MAPT (0.42) | ALDH1A1TDP1RECQLCYP3A4THRB | |
| Bromide SCHEMBL26108834 | 0.75 | MAPT (0.42) | ALDH1A1TDP1RECQLCYP3A4LMNA |
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-2008053300-A1 | PYRAZOLINE COMPOUNDS AS MINERALOCORTICOID RECEPTOR ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2008-05-08 | — | — | WO | disclosed |