Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CCKBR | P32239 | 3/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.34 |
| ▸ | HSPA8 | P11142 | 2/20 | 0.34 |
| ▸ | HSPA2 | P54652 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9750383 | 0.94 | DRD2 (0.38) | DRD2DRD3GAAHPGDTAS1R3 | |
| SCHEMBL9750398 | 0.85 | DRD2 (0.39) | DRD2DRD3GAAHPGDTAS1R3 | |
| SCHEMBL9749911 | 0.84 | ABCB1 (0.39) | GAA | |
| SCHEMBL9749280 | 0.82 | DRD3 (0.41) | DRD2DRD3TAS1R3TAS1R1KDM4E | |
| SCHEMBL9749806 | 0.81 | CCKBR (0.39) | DRD2DRD3GAAHPGDTAS1R3 | |
| SCHEMBL9749935 | 0.78 | ABCB1 (0.38) | LMNAALDH1A1 | |
| SCHEMBL9750393 | 0.77 | DRD3 (0.42) | DRD2DRD3KDM4EALDH1A1HTR2C | |
| SCHEMBL23111879 | 0.70 | DRD2 (0.64) | DRD2DRD3GAAHPGDNPC1 | |
| SCHEMBL9750357 | 0.69 | CYP1A2 (0.34) | GAA | |
| SCHEMBL9750418 | 0.67 | DRD3 (0.42) | DRD2DRD3KDM4EALDH1A1HTR2C |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0131006-B1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1992-06-10 | — | — | EP | disclosed |
| EP-0131006-A4 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-06-06 | — | — | EP | disclosed |
| US-4508725-A | BETA-ADRENERGIC BLOCKING AGENTS; GLAUCOMA TREATMENT | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1985-04-02 | — | — | US | disclosed |
| EP-0131006-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-01-16 | — | — | EP | disclosed |
| WO-1984002525-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES | AMERICAN HOSPITAL SUPPLY CORP (US) | 1984-07-05 | — | — | WO | disclosed |