Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | KLK7 | P49862 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10399769 | 0.89 | ALDH1A1 (0.66) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19664220 | 0.85 | ALDH1A1 (0.62) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9824533 | 0.84 | ALDH1A1 (0.48) | ALDH1A1KMT2ANPC1RAB9AHPGD | |
| SCHEMBL3975330 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28784413 | 0.83 | ALDH1A1 (0.59) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7430396 | 0.83 | TSHR (0.62) | ALDH1A1KMT2ANPC1RAB9ACYP1A2 | |
| SCHEMBL132139 | 0.81 | NPC1 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL9533824 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10400039 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9385235 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0261442-B1 | MALONIC ACID DERIVATIVES | NIHON NOHYAKU CO., LTD. (JP) | 1991-11-13 | — | — | EP | disclosed |
| US-4835153-A | LIVER DISORDERS | NIHON NOHYAKU CO., LTD. (JP) | 1989-05-30 | — | — | US | disclosed |
| EP-0261442-A1 | Malonic acid derivatives | NIHON NOHYAKU CO., LTD. (JP) | 1988-03-30 | — | — | EP | disclosed |