Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 5/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16661306 | 0.88 | DGAT1 (0.41) | DGAT1TDP1NR1H2CA1CA7 | |
| SCHEMBL1735484 | 0.79 | DGAT1 (0.46) | DGAT1TDP1NR1H2CA1CA2 | |
| SCHEMBL28355700 | 0.79 | DGAT1 (0.46) | DGAT1TDP1NR1H2CA1CA2 | |
| SCHEMBL17801117 | 0.77 | DGAT1 (0.44) | DGAT1TDP1NR1H2CA1CA2 | |
| SCHEMBL24960518 | 0.77 | DGAT1 (0.40) | DGAT1 | |
| SCHEMBL473483 | 0.75 | DGAT1 (0.43) | DGAT1TDP1NR1H2 | |
| SCHEMBL6948226 | 0.75 | HMGCR (0.44) | DGAT1TDP1GAAMEN1KMT2A | |
| SCHEMBL10676675 | 0.75 | DGAT1 (0.43) | DGAT1TDP1NR1H2 | |
| SCHEMBL473482 | 0.75 | DGAT1 (0.43) | DGAT1TDP1NR1H2 | |
| SCHEMBL28330411 | 0.75 | DGAT1 (0.48) | DGAT1TDP1NR1H2 |
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-5417959-A | Functionalized aza-crytand ligands for diagnostic imaging applications | MALLINCKRODT MEDICAL, INC. (US) | 1995-05-23 | — | — | US | disclosed |
| WO-1995010217-A2 | FUNCTIONALIZED AZA-CRYPTAND LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1995-04-20 | — | — | WO | disclosed |