Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNA2 | P16389 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1002679 | 0.91 | CYP3A4 (0.49) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| Hydrochloric Acid SCHEMBL9098003 | 0.90 | ADORA3 (0.48) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| SCHEMBL6554781 | 0.77 | SRC (0.45) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| SCHEMBL25393535 | 0.70 | ALDH2 (0.50) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| SCHEMBL30054772 | 0.70 | ALDH2 (0.50) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| SCHEMBL6802035 | 0.67 | ALDH1A1 (0.70) | HPGDCYP3A4ADORA3CYP1A1THRB | |
| SCHEMBL698745 | 0.66 | ALDH2 (0.45) | HPGDTHRBMAPK1HSD17B3ALDH1A1 | |
| SCHEMBL6994969 | 0.66 | ALDH2 (0.56) | HPGDCYP3A4ADORA3CYP1A1HSD17B3 | |
| SCHEMBL27907872 | 0.66 | ALDH2 (0.47) | HPGDCYP3A4MAPK1HSD17B3ALDH1A1 | |
| SCHEMBL17525029 | 0.65 | ALDH2 (0.59) | HPGDADORA3THRBMAPK1HSD17B3 |
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-8658780-B2 | Triggered covalent probes for imaging and silencing genetic expression | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2014-02-25 | — | — | US | disclosed |
| US-20110288148-A1 | TRIGGERED COVALENT PROBES FOR IMAGING AND SILENCING GENETIC EXPRESSION | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2011-11-24 | — | — | US | disclosed |
| US-20100021904-A1 | SHIELDED CROSS-LINKING PROBES | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-01-28 | — | — | US | disclosed |