Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 2/20 | 0.37 |
| ▸ | PLAU | P00749 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | PLAT | P00750 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | LIPE | Q05469 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9435442 | 0.86 | CTRB1 (0.50) | ALDH1A1HPGDCTRB1F2PLAU | |
| SCHEMBL9541937 | 0.84 | CTRB1 (0.41) | ALDH1A1HPGDCTRB1F2PLAU | |
| SCHEMBL9541605 | 0.78 | CTRB1 (0.44) | ALDH1A1CTRB1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6243677 | 0.78 | CTRB1 (0.44) | ALDH1A1CTRB1F2PLAUPLG | |
| SCHEMBL192372 | 0.78 | CTRB1 (0.63) | ALDH1A1HPGDCTRB1F2PLAU | |
| SCHEMBL9541923 | 0.77 | CTRB1 (0.41) | ALDH1A1HPGDCTRB1F2PLAU | |
| SCHEMBL21470639 | 0.77 | DDB1 (0.55) | ALDH1A1HPGDCTRB1CYP19A1DDB1 | |
| SCHEMBL10691934 | 0.73 | SLC6A2 (0.46) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9544321 | 0.73 | CTRB1 (0.40) | ALDH1A1CTRB1F2PLAUMAPT | |
| SCHEMBL11502990 | 0.73 | GLA (0.43) | ALDH1A1HPGDCTRB1SLC6A2SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993015093-A1 | SPECIFIC CONTRAST AGENTS FOR MAGNETIC RESONANCE IMAGING OF THE SMALL INTESTINE AND HEPATOBILIARY SYSTEM | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1993-08-05 | — | — | WO | disclosed |