Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.63 |
| ▸ | GFER | P55789 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 5/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.54 |
| ▸ | WNT3A | P56704 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NAAA | Q02083 | 1/20 | 0.54 |
| ▸ | PREP | P48147 | 1/20 | 0.54 |
| ▸ | FAP | Q12884 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL31329318 | 0.88 | NPC1 (0.64) | ALDH1A1KMT2AGFERNPC1TDP1 | |
| SCHEMBL6692694 | 0.84 | HPGD (0.59) | ALDH1A1KMT2AGFERNPC1TDP1 | |
| SCHEMBL11792815 | 0.83 | HTT (0.73) | ALDH1A1KMT2ANPC1TDP1HPGD | |
| SCHEMBL3401497 | 0.83 | SIGMAR1 (0.60) | ALDH1A1KMT2AGFERNPC1TDP1 | |
| SCHEMBL3083321 | 0.82 | MAPT (0.71) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4377352 | 0.81 | HRH3 (0.76) | ALDH1A1MAPTPREPFAP | |
| SCHEMBL8341678 | 0.80 | HTT (0.68) | ALDH1A1KMT2ANPC1TDP1HPGD | |
| Hydrochloric Acid SCHEMBL4377272 | 0.79 | HRH3 (0.77) | ALDH1A1MAPTPREPFAP | |
| SCHEMBL4472849 | 0.78 | ALDH1A1 (0.70) | ALDH1A1KMT2AGFERNPC1HPGD | |
| SCHEMBL3070168 | 0.77 | HTR1A (0.69) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6566375-B1 | For therapy of atherosclerosis | WYETH | 2003-05-20 | — | — | US | disclosed |
| US-6316467-B1 | Elevation of HDL cholesterol by 4-[(Aminothioxomethyl)-hydrazono]-N-(substituted)-4-arylbutanamides | AMERICAN HOME PRODUCTS CORPORATION | 2001-11-13 | — | — | US | disclosed |