Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PTPRB | P23467 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844782 | 0.83 | TSHR (0.50) | TSHRCYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL28499841 | 0.78 | CTSK (0.48) | TSHRCYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL24876970 | 0.77 | CTSK (0.47) | TSHRCYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL27387679 | 0.76 | CTSS (0.45) | CTSKCTSSMAPTALDH1A1HSD17B10 | |
| SCHEMBL6865748 | 0.76 | ALDH1A1 (0.46) | NLRP3ALDH1A1HSD17B10 | |
| SCHEMBL18683323 | 0.75 | TSHR (0.46) | TSHRCYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL5744515 | 0.75 | ATM (0.60) | TSHRCTSKCTSSALDH1A1SYK | |
| SCHEMBL5742902 | 0.75 | ATM (0.60) | TSHRCTSKCTSSALDH1A1SYK | |
| SCHEMBL4596352 | 0.74 | ATM (0.43) | TSHRCTSKCTSSMAPTALDH1A1 | |
| SCHEMBL3820956 | 0.74 | ATM (0.43) | TSHRCTSKCTSSMAPTALDH1A1 |
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-4575503-A | ANGIOTENSIN CONVERTING ENZYME INHIBITOR, HYPOTENSIVE | CIBA-GEIGY CORPORATION (US) | 1986-03-11 | — | — | US | disclosed |
| US-4473575-A | ANGIOTENSIN INHIBITORS, HYPOTENSIVE AGENTS | CIBA-GEIGY CORPORATION (US) | 1984-09-25 | — | — | US | disclosed |
| US-4410520-A | ANGIOTENSION CONVERTING ENZYME INGIBITOR, HYPOTENSIVE AGENTS | CIBA-GEIGY CORPORATION (US) | 1983-10-18 | — | — | US | disclosed |