Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | FBP1 | P09467 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | MC5R | P33032 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | CCR2 | P41597 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30602945 | 0.86 | TDP1 (0.45) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL9300879 | 0.86 | TDP1 (0.45) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL11590047 | 0.78 | XIAP (0.40) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL1801464 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL7905015 | 0.76 | ALDH1A1 (0.46) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL22457218 | 0.76 | XIAP (0.48) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| Bromide SCHEMBL4961408 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL2170681 | 0.76 | RAB9A (0.53) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL29843187 | 0.76 | RAB9A (0.53) | ALDH1A1HSD17B10TDP1ALOX15HPGD | |
| SCHEMBL2211087 | 0.76 | XIAP (0.44) | ALDH1A1HSD17B10TDP1ALOX15HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4138346-A | ETHOXYLATED PHOSPHATE ESTER WITH A MERCAPTOTHIAZOLE, A DITHIOBIS-THIAZOLE, A SULFIDE, A DISULFIDE OR A SULFONE | BASF WYANDOTTE CORPORATION (US) | 1979-02-06 | — | — | US | claimed |
| US-3933658-A | PHOSPHATE ESTER AND SULFUR COMPOUND | GAF CORPORATION (US) | 1976-01-20 | — | — | US | claimed |
| US-4343660-A | PETROLEUM SULFONATE AND COMPLEXING AGENT, FOR COPPER CABLES | PETROLITE CORPORATION (US) | 1982-08-10 | — | — | US | disclosed |