Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.38 |
| ▸ | PPARG | P37231 | 7/20 | 0.38 |
| ▸ | PPARD | Q03181 | 7/20 | 0.38 |
| ▸ | PPARA | Q07869 | 7/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TLR2 | O60603 | 2/20 | 0.38 |
| ▸ | FABP4 | P15090 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4879417 | 0.86 | TDP1 (0.38) | AKR1B1TSHRTDP1ALDH1A1FFAR1 | |
| SCHEMBL28906293 | 0.80 | AKR1B1 (0.41) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL14042583 | 0.79 | FAAH (0.38) | ALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL4882584 | 0.78 | AKR1B1 (0.39) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL24013364 | 0.78 | FAAH (0.37) | TSHRALDH1A1ALOX15HSD17B10 | |
| SCHEMBL8896813 | 0.77 | FAAH (0.41) | AKR1B1ALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL2467542 | 0.77 | LDHA (0.40) | TSHRTDP1ALDH1A1FFAR1MEN1 | |
| SCHEMBL249872 | 0.77 | ACLY (0.56) | AKR1B1GPR84PPARGPPARATSHR | |
| SCHEMBL1947968 | 0.75 | AKR1B1 (0.41) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL20169528 | 0.75 | CES2 (0.42) | TSHRMEN1ALOX15KMT2AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104053443-B | Composition for preventing or treating arteriosclerosis comprising compound natural marine cyclic depsipeptide | KOREA INSTITUTE OF OCEAN SCIENCE & TECHNOLOGY (KR) | 2015-11-25 | — | — | CN | disclosed |