Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL9450076 | 0.78 | CYP2D6 (0.45) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL11471791 | 0.75 | CCR1 (0.46) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL25309625 | 0.75 | SMN1; SMN2 (0.39) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL31676050 | 0.75 | SMN1; SMN2 (0.39) | BLMTDP1CHRM2CYP2D6ALDH1A1 | |
| SCHEMBL10932537 | 0.74 | ATM (0.40) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL11619910 | 0.72 | CYP2D6 (0.70) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL8892352 | 0.72 | BLM (0.45) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL9581143 | 0.72 | CYP3A4 (0.60) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL8891230 | 0.71 | SMN1; SMN2 (0.43) | BLMCYP3A4TDP1SLC22A2SLC22A1 | |
| SCHEMBL9397304 | 0.70 | CYP2D6 (0.44) | BLMCYP3A4TDP1SLC22A2SLC22A1 |
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-4225723-A | Process for the preparation of substituted arylcyanoalkyl and diaryl cyanoalkylimidazoles | ROHM AND HAAS COMPANY (US) | 1980-09-30 | — | — | US | disclosed |
| US-4143137-A | SUBSTITUTED ARYLCYANOALKYL AND DIARYLCYANOALKYLIMIDAZOLE METAL SALT COMPLEXES AND FUNGICIDAL COMPOSITIONS AND METHODS UTILIZING THEM | ROHM AND HAAS COMPANY (US) | 1979-03-06 | — | — | US | disclosed |
| US-4073921-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1978-02-14 | — | — | US | disclosed |