Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.39 |
| ▸ | BDKRB1 | P46663 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM6B | O15054 | 2/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2819085 | 0.92 | HSD17B2 (0.46) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2819081 | 0.92 | HSD17B2 (0.46) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL13190089 | 0.91 | HSD17B2 (0.44) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2816141 | 0.85 | ALDH1A1 (0.47) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2816139 | 0.85 | ALDH1A1 (0.47) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2817719 | 0.84 | HSD17B2 (0.47) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2817718 | 0.84 | HSD17B2 (0.47) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL784603 | 0.79 | ALDH1A1 (0.50) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL784602 | 0.79 | ALDH1A1 (0.50) | HSD17B2ALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL784976 | 0.79 | ALDH1A1 (0.49) | ALDH1A1TAS1R3TAS1R1TAS1R2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010108651-A1 | SUBSTITUTED SPIRO-AMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2010-09-30 | — | — | WO | disclosed |