Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.73 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.70 |
| ▸ | PPARG | P37231 | 7/20 | 0.70 |
| ▸ | PPARD | Q03181 | 7/20 | 0.70 |
| ▸ | PPARA | Q07869 | 7/20 | 0.70 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.70 |
| ▸ | TSHR | P16473 | 5/20 | 0.70 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.70 |
| ▸ | FABP4 | P15090 | 3/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | TLR2 | O60603 | 2/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.70 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.70 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.70 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.70 |
| ▸ | MEN1 | O00255 | 1/20 | 0.70 |
| ▸ | ESR1 | P03372 | 1/20 | 0.70 |
| ▸ | PDE4A | P27815 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL7743610 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL2229369 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL16539035 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL7201642 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL7749100 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL11477071 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL15593804 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL8865709 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL23891 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL14166454 | 0.98 | GPR84 (0.74) | AKR1B1GPR84PPARGPPARDPPARA |
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-5679671-A | ANGIOTENSIN 1-CONVERTING ENZYME INHIBITOR, VASOPRESSIN ANTAGONISM AND ATRIAL NAUTRIURETIC PEPTIDE HYDROLASE INHIBITOR | EISAI CO., LTD. (JP) | 1997-10-21 | — | — | US | disclosed |
| EP-0671172-A1 | AMINO ACID DERIVATIVE | Eisai Co., Ltd. (JP) | 1995-09-13 | — | — | EP | disclosed |