Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986002 | 0.89 | RXRA (0.45) | ALDH1A1HPGDTAS2R14MEN1KMT2A | |
| SCHEMBL6986008 | 0.88 | MEN1 (0.39) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL6982667 | 0.85 | NR3C1 (0.41) | ALDH1A1HPGDTAS2R14MEN1KMT2A | |
| SCHEMBL6977636 | 0.85 | ALDH1A1 (0.42) | ALDH1A1HPGDTAS2R14MEN1KMT2A | |
| SCHEMBL6979172 | 0.85 | KDM1A (0.41) | ALDH1A1HPGDTAS2R14MEN1KMT2A | |
| SCHEMBL6987628 | 0.84 | NR3C1 (0.48) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL6981595 | 0.83 | LTB4R2 (0.46) | ALDH1A1HPGDMEN1KMT2ANPC1 | |
| SCHEMBL6984169 | 0.83 | KDM1A (0.38) | ALDH1A1RORCNR3C1NPC1MAPT | |
| SCHEMBL6981987 | 0.82 | PTGER4 (0.38) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL6982692 | 0.82 | L3MBTL1 (0.38) | ALDH1A1LMNANR3C1NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |