Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | CETP | P11597 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KLK8 | O60259 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | KLK2 | P20151 | 1/20 | 0.42 |
| ▸ | KLK4 | Q9Y5K2 | 1/20 | 0.42 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14277384 | 0.89 | TSHR (0.50) | TSHRCETPCYP2D6KLK8PLAU | |
| SCHEMBL11509944 | 0.84 | CETP (0.49) | TSHRCETPCYP2D6KLK8PLAU | |
| SCHEMBL5248630 | 0.82 | CETP (0.47) | TSHRCETPPOLB | |
| SCHEMBL5028595 | 0.82 | TSHR (0.60) | TSHRCETP | |
| SCHEMBL1243459 | 0.82 | TSHR (0.55) | TSHRCETPPOLB | |
| SCHEMBL5404588 | 0.82 | CETP (0.58) | TSHRCETP | |
| SCHEMBL5327008 | 0.81 | TSHR (0.63) | TSHRCETP | |
| SCHEMBL13896611 | 0.81 | TSHR (0.53) | TSHRCETPCYP2D6POLB | |
| SCHEMBL4154482 | 0.81 | TSHR (0.53) | TSHRCETPPOLB | |
| SCHEMBL11148077 | 0.79 | TSHR (0.52) | TSHRCETP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4963539-A | TREATING HEART FAILURE, PAIN OR DIARRHEA | E. R. SQUIBB & SONS, INC. (US) | 1990-10-16 | — | — | US | disclosed |
| EP-0306879-A2 | Phosphonate and phosphonamide endopeptidase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1989-03-15 | — | — | EP | disclosed |