Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11471791 | 0.84 | CCR1 (0.46) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL11619910 | 0.81 | CYP2D6 (0.70) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL3979738 | 0.80 | CYP2D6 (0.58) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL10932537 | 0.80 | ATM (0.40) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL9397304 | 0.79 | CYP2D6 (0.44) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL8892352 | 0.78 | BLM (0.45) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL9581143 | 0.78 | CYP3A4 (0.60) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL11488154 | 0.78 | BLM (0.38) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL8891230 | 0.77 | SMN1; SMN2 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL21246245 | 0.76 | SMN1; SMN2 (0.44) | CYP2D6CHRM2CCR1RAB9ASMN1; SMN2 |
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-5240925-A | FUNGICIDAL 2-ARYL-2-CYANO-2-(HETEROCYCLYLALKYL)ETHYL-1,2,4-TRIAZOLES | ROHM AND HAAS COMPANY (US) | 1993-08-31 | — | — | US | disclosed |
| EP-0529973-A1 | Fungicidal 2-aryl-2-cyano-2-(heterocyclylalkyl)ethyl-1,2,4-triazoles | ROHM AND HAAS COMPANY (US) | 1993-03-03 | — | — | EP | disclosed |