Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 11/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7407796 | 0.99 | DRD2 (0.49) | DRD2DRD4DRD3CHRM3ALOX5 | |
| SCHEMBL7412311 | 0.80 | HTR6 (0.61) | HTR6 | |
| SCHEMBL7456887 | 0.77 | MCHR1 (0.50) | HTR6 | |
| SCHEMBL11423799 | 0.73 | CHRM3 (0.56) | DRD2DRD3CHRM3HTR6DRD1 | |
| Hydrochloric Acid SCHEMBL7450769 | 0.72 | CHRM3 (0.55) | DRD2CHRM3HTR6DRD1 | |
| SCHEMBL12127620 | 0.71 | HTR6 (0.38) | DRD2DRD3ALOX5PTGS1PTGS2 | |
| SCHEMBL7407559 | 0.71 | CHRM3 (0.47) | DRD2DRD4DRD3CHRM3HTR6 | |
| SCHEMBL7409136 | 0.71 | HTR6 (0.38) | DRD2CHRM3HTR6DRD1 | |
| SCHEMBL21089058 | 0.70 | PTGDR2 (0.38) | HTR6 | |
| SCHEMBL12127658 | 0.70 | HTR6 (0.41) | HTR6 |
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-4224335-A | INOTROPIC AGENTS USED FOR TREATING CONGESTIVE HEART FAILURE IN MAMMALS | STERLING DRUG INC. (US) | 1980-09-23 | — | — | US | claimed |
| US-4224335-A | INOTROPIC AGENTS USED FOR TREATING CONGESTIVE HEART FAILURE IN MAMMALS | STERLING DRUG INC. (US) | 1980-09-23 | — | — | US | disclosed |