Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.39 |
| ▸ | PPARG | P37231 | 7/20 | 0.39 |
| ▸ | PPARD | Q03181 | 7/20 | 0.39 |
| ▸ | PPARA | Q07869 | 7/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.39 |
| ▸ | TLR2 | O60603 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.39 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21702870 | 0.88 | GABRP (0.40) | ALDH1A1AKR1B1NOD1GABRPGABRD | |
| SCHEMBL21702868 | 0.85 | ALDH1A1 (0.51) | ALDH1A1AKR1B1NOD1GPR84PPARG | |
| SCHEMBL2734881 | 0.82 | ALDH1A1 (0.52) | ALDH1A1NOD1TSHRTDP1ESR1 | |
| SCHEMBL2734865 | 0.82 | ALDH1A1 (0.52) | ALDH1A1NOD1TSHRTDP1ESR1 | |
| SCHEMBL9212582 | 0.81 | SLC7A5 (0.48) | ALDH1A1NOD1HDAC11TSHRSLC22A6 | |
| SCHEMBL15623792 | 0.81 | SLC1A3 (0.38) | ALDH1A1NOD1TSHRALOX15HSD17B10 | |
| SCHEMBL7599884 | 0.80 | ALDH1A1 (0.42) | ALDH1A1AKR1B1GPR84PPARGPPARD | |
| SCHEMBL7599881 | 0.80 | ALDH1A1 (0.42) | ALDH1A1AKR1B1GPR84PPARGPPARD | |
| SCHEMBL2123202 | 0.80 | NOD1 (0.51) | ALDH1A1AKR1B1NOD1GPR84PPARG | |
| SCHEMBL18686280 | 0.80 | GABRP (0.45) | ALDH1A1AKR1B1GPR84PPARGPPARD |
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-2020030663-A1 | CLEAVABLE LINKER FOR PEPTIDE SYNTHESIS | F. HOFFMANN-LA ROCHE AG (CH) | 2020-02-13 | — | — | WO | disclosed |