Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8013823 | 0.95 | APP (0.52) | APPMAPTCYP3A4TDP1CYP1A2 | |
| SCHEMBL1648252 | 0.81 | TDP1 (0.50) | APPCYP3A4TDP1CA12CA1 | |
| SCHEMBL6852428 | 0.80 | CYP3A4 (0.39) | APPMAPTCYP3A4TDP1CYP1A2 | |
| SCHEMBL10977054 | 0.74 | CYP3A4 (0.43) | APPCYP3A4TDP1KDM4E | |
| SCHEMBL16487750 | 0.72 | CYP3A4 (0.41) | CYP3A4TDP1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL3794627 | 0.70 | CYP3A4 (0.45) | APPCYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL1348128 | 0.70 | APP (0.61) | APPMAPTCYP3A4CYP1A2CYP1A1 | |
| SCHEMBL10981315 | 0.70 | CYP3A4 (0.39) | CYP3A4TDP1 | |
| SCHEMBL8424451 | 0.69 | CYP3A4 (0.43) | APPMAPTCYP3A4TDP1CYP1A2 | |
| SCHEMBL2114741 | 0.68 | APP (0.92) | APPMAPTCYP3A4CYP1A2CYP1A1 |
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-6828439-B1 | Compounds, composition, and methods for photodynamic therapy | ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. | 2004-12-07 | — | — | US | disclosed |