Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL970082 | 0.98 | CYP3A4 (0.37) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL28524183 | 0.95 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL27973323 | 0.95 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL28078694 | 0.95 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL28087083 | 0.95 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL28052382 | 0.95 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL11308789 | 0.93 | CA1 (0.33) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL3821722 | 0.91 | CA1 (0.37) | CA1CA2TSHRHPGD | |
| SCHEMBL1725447 | 0.91 | CYP3A4 (0.36) | CYP3A4ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL3820049 | 0.88 | CA1 (0.39) | CA1CA2TSHRHPGD |
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-20020064638-A1 | Modified with an organic or inorganic phosphate, phosphite, or hypophosphite compound; internal electrode for multi-layered capacitors; inhibit any generation of delamination and crack-formation during production | MITSUI MINING AND SMELTING CO., LTD. | 2002-05-30 | — | — | US | disclosed |