Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 10/20 | 0.50 |
| ▸ | CFTR | P13569 | 1/20 | 0.49 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21971630 | 0.93 | NPSR1 (0.51) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971090 | 0.91 | NPSR1 (0.53) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL24224558 | 0.88 | NPSR1 (0.58) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971125 | 0.88 | NPSR1 (0.58) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971796 | 0.88 | NPSR1 (0.51) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL19806877 | 0.88 | MEN1 (0.49) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971798 | 0.87 | NPSR1 (0.49) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971127 | 0.87 | NPSR1 (0.49) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971092 | 0.86 | NPSR1 (0.50) | NPSR1CFTRGOPCCYP1A2CYP2C19 | |
| SCHEMBL21971792 | 0.85 | NPSR1 (0.46) | NPSR1CFTRGOPCCYP1A2CYP2C19 |
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-20200144518-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2020-05-07 | — | — | US | disclosed |