Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1897234 | 0.87 | CYP3A4 (0.49) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL29030397 | 0.84 | CYP3A4 (0.53) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL30385424 | 0.83 | TSHR (0.67) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL2002577 | 0.83 | TSHR (0.67) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL6551356 | 0.83 | CYP3A4 (0.77) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL4371870 | 0.81 | CYP3A4 (0.50) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL1896572 | 0.81 | CYP3A4 (0.50) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL23404252 | 0.80 | CYP3A4 (0.47) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL30242196 | 0.80 | CYP3A4 (0.47) | CYP3A4TSHRALDH1A1HSD17B10NPC1 | |
| SCHEMBL4905609 | 0.80 | ALDH1A1 (0.69) | CYP3A4TSHRALDH1A1HSD17B10TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4835312-A | Production process of N-substituted amide compounds | MITSUI CHEMICALS, INCORPORATED (JP) | 1989-05-30 | — | — | US | disclosed |