Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 5/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 6/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | ELANE | P08246 | 2/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10541866 | 0.85 | HCAR1 (0.45) | HCAR1KDM4EALDH1A1POLB | |
| SCHEMBL10539417 | 0.85 | HCAR1 (0.36) | HCAR1ALDH1A1HPGDELANE | |
| SCHEMBL10541722 | 0.85 | HCAR1 (0.43) | HCAR1CHRNA7KDM4EALDH1A1POLB | |
| SCHEMBL11056926 | 0.81 | HCAR1 (0.46) | HCAR1CHRNA7ALDH1A1CYP1A2POLB | |
| Hydrochloric Acid SCHEMBL11056262 | 0.80 | HCAR1 (0.44) | HCAR1CHRNA7ALDH1A1CYP1A2POLB | |
| SCHEMBL10541978 | 0.80 | HCAR1 (0.40) | HCAR1CHRNA7ALDH1A1 | |
| SCHEMBL10540570 | 0.80 | HCAR1 (0.40) | HCAR1CHRNA7POLB | |
| SCHEMBL10538224 | 0.79 | HCAR1 (0.46) | HCAR1ALDH1A1POLBHPGD | |
| SCHEMBL10538309 | 0.79 | HCAR1 (0.34) | HCAR1 | |
| SCHEMBL11059656 | 0.78 | HCAR1 (0.43) | HCAR1CHRNA7KDM4EALDH1A1CYP1A2 |
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-RE33125-E | HYPOTENSIVE AGENTS | RORER PHARMACEUTICAL CORPORATION (US) | 1989-12-05 | — | — | US | disclosed |
| US-4460585-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1984-07-17 | — | — | US | disclosed |