Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.42 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6544635 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TSHRSMN1; SMN2NPC1KDM4E | |
| SCHEMBL563306 | 0.85 | LTB4R (0.54) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD | |
| SCHEMBL23027267 | 0.85 | LTB4R (0.54) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD | |
| SCHEMBL13572924 | 0.85 | LTB4R (0.54) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD | |
| SCHEMBL9764581 | 0.83 | FAAH (0.46) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD | |
| SCHEMBL29069352 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD | |
| SCHEMBL10391474 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL295741 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL7056947 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL7178642 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TSHRSMN1; SMN2NPC1HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE39333-E1 | Process for the preparation of 5-hydroxy-3-oxopentanoic acid derivatives | KANEKA CORPORATION (JP) | 2006-10-10 | — | — | US | disclosed |
| EP-1104750-B1 | PROCESSES FOR THE PREPARATION OF 5-HYDROXY-3-OXOPENTANOIC ACID DERIVATIVES | KANEKA CORP (JP) | 2004-04-14 | — | — | EP | disclosed |
| US-6340767-B1 | REACTION OF LITHIUM AMIDE WITH ACETIC ACID ESTER AND HYDROXY PROPIONIC ACID | KANEKA CORPORATION (JP) | 2002-01-22 | — | — | US | disclosed |
| EP-1104750-A1 | PROCESSES FOR THE PREPARATION OF 5-HYDROXY-3-OXOPENTANOIC ACID DERIVATIVES | KANEKA CORPORATION (JP) | 2001-06-06 | — | — | EP | disclosed |