Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | HMBS | P08397 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1738125 | 0.73 | HMBS (0.46) | ALDH1A1KDM4EHSD17B10HPGDHMBS | |
| Hydrochloric Acid SCHEMBL5709777 | 0.71 | HMBS (0.43) | ALDH1A1KDM4EHSD17B10HPGDHMBS | |
| SCHEMBL20160825 | 0.70 | HMBS (0.42) | MAPK1ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL2904372 | 0.70 | GRIA1 (0.43) | ALDH1A1KDM4EHSD17B10HPGDHMBS | |
| SCHEMBL5273095 | 0.69 | CYP1A2 (0.41) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL5010692 | 0.68 | HMBS (0.40) | MAPK1ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL20565249 | 0.68 | EGFR (0.35) | HPGDKMT2AL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL19974316 | 0.67 | MAOB (0.44) | ALDH1A1KMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL22904635 | 0.66 | HMBS (0.37) | ALDH1A1KDM4EHSD17B10HPGDHMBS | |
| SCHEMBL6301740 | 0.66 | KDM4A (0.38) | ALDH1A1HPGDMAPTKMT2AL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2475676-A2 | Pregnane derivatives condensed in the 16,17 position with an N-substituted isoxazolidine ring as anti-inflammatory agents | Chiesi Farmaceutici S.p.A. (IT) | 2012-07-18 | — | — | EP | disclosed |
| WO-2011029547-A2 | PREGNANE DERIVATIVES CONDENSED IN THE 16, 17 POSITION WITH AN N-SUBSTITUTED ISOXAZOLIDINE RING AS ANTI-INFLAMMATORY AGENTS | CHIESI FARMACEUTICI S.P.A. (IT) | 2011-03-17 | — | — | WO | disclosed |