Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7258064 | 0.88 | — | — | |
| SCHEMBL28664742 | 0.87 | HSD17B10 (0.36) | TAAR1CYP3A4HSD17B10TDP1 | |
| SCHEMBL3995632 | 0.87 | HSD17B10 (0.38) | TAAR1CYP3A4HSD17B10TDP1 | |
| SCHEMBL7257246 | 0.83 | ALDH1A1 (0.34) | HSD17B10 | |
| SCHEMBL2141057 | 0.81 | MAOA (0.39) | HSD17B10 | |
| SCHEMBL27787590 | 0.81 | KIT (0.31) | — | |
| SCHEMBL27940872 | 0.80 | CYP3A4 (0.32) | TAAR1CYP3A4HSD17B10TDP1 | |
| SCHEMBL5050049 | 0.80 | — | — | |
| SCHEMBL29154457 | 0.80 | TAAR1 (0.36) | TAAR1CYP3A4HSD17B10TDP1 | |
| SCHEMBL1863477 | 0.80 | ALDH1A1 (0.37) | CYP3A4TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101805362-B | Porphyrin modified by diethylenetriamine pentaacetic acid gadolinium and preparation method and application thereof | INST BIOMEDICAL ENG CAMS | 2012-09-05 | — | — | CN | disclosed |
| CN-101805362-A | Porphyrin modified by diethylenetriamine pentaacetic acid gadolinium and preparation method and application thereof | INST BIOMEDICAL ENG CAMS | 2010-08-18 | — | — | CN | disclosed |