Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.33 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7015525 | 0.79 | AGTR1 (0.41) | AGTR1AGTR2PTPRCPTPN2PTPN1 | |
| SCHEMBL7015176 | 0.70 | AGTR1 (0.49) | AGTR1AGTR2ABCB11LTB4R2 | |
| SCHEMBL7017110 | 0.70 | AGTR1 (0.48) | AGTR1AGTR2ABCB11LTB4R2 | |
| SCHEMBL7015549 | 0.69 | AGTR1 (0.47) | AGTR1AGTR2ABCB11LTB4R2 | |
| SCHEMBL8911545 | 0.68 | AGTR1 (0.41) | AGTR1AGTR2PDE3AABCB11EGFR | |
| SCHEMBL8931859 | 0.68 | EGLN3 (0.43) | APAF1CYP3A4CYP2C9 | |
| SCHEMBL3795625 | 0.67 | HDAC8 (0.55) | DNMT3AHDAC8APAF1CYP3A4CYP2C9 | |
| SCHEMBL8932004 | 0.66 | AGTR1 (0.42) | AGTR1AGTR2ABCB11LTB4R2 | |
| SCHEMBL7016171 | 0.65 | — | — | |
| SCHEMBL8931908 | 0.65 | AGTR1 (0.39) | AGTR1AGTR2PDE3AABCB11EGFR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5693633-A | Angiotensin II antagonists | ELI LILLY AND COMPANY (US) | 1997-12-02 | — | — | US | disclosed |