Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MTOR | P42345 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21556952 | 0.72 | ADRB1 (0.42) | HSD17B10ALDH1A1GAAHPGDADRB1 | |
| SCHEMBL20852558 | 0.68 | BCAT2 (0.35) | ADRB1ADRB3ADRA2AADRA2BADRA2C | |
| SCHEMBL20852540 | 0.64 | ADRA2A (0.43) | HSD17B10ALDH1A1GAAADRB1MAPT | |
| SCHEMBL8729716 | 0.63 | TDP1 (0.51) | HSD17B10ALDH1A1GAAHPGDALOX15 | |
| SCHEMBL8729724 | 0.63 | TDP1 (0.51) | HSD17B10ALDH1A1GAAHPGDALOX15 | |
| SCHEMBL20852436 | 0.63 | MMP13 (0.35) | ALDH1A1HPGDMAPTTSHRLMNA | |
| SCHEMBL14100448 | 0.61 | TDP1 (0.68) | HSD17B10ALDH1A1GAAHPGDADRB1 | |
| SCHEMBL5954405 | 0.61 | MAPT (0.54) | HSD17B10ALDH1A1GAAHPGDALOX15 | |
| SCHEMBL25917338 | 0.61 | TDP1 (0.68) | HSD17B10ALDH1A1GAAHPGDADRB1 | |
| SCHEMBL8018210 | 0.60 | ADRB2 (0.72) | HSD17B10ALDH1A1GAAHPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3567029-A1 | COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS | Lantheus Medical Imaging, Inc. (US) | 2019-11-13 | — | — | EP | disclosed |