Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.55 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 8/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | SI | P14410 | 3/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6657865 | 0.81 | ADRB2 (0.58) | ADRB2PARP1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL6509697 | 0.81 | ADRB2 (0.58) | ADRB2PARP1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL5989876 | 0.81 | ADRB2 (0.42) | ADRB2PARP1DHODHHTTMGAM | |
| SCHEMBL8265189 | 0.81 | HRH4 (0.46) | ADRB2PARP1DHODHHTTMGAM | |
| SCHEMBL24463162 | 0.78 | ADRB2 (0.41) | ADRB2PARP1DHODHHTTMGAM | |
| SCHEMBL6508965 | 0.78 | PARP1 (0.42) | ADRB2PARP1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL1285968 | 0.78 | ADRB2 (0.55) | ADRB2PARP1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL13594653 | 0.77 | ADRB2 (0.52) | ADRB2PARP1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL10299139 | 0.75 | ADRB2 (0.42) | ADRB2PARP1DHODHHTTHRH4 | |
| SCHEMBL12727166 | 0.75 | ADRB2 (0.39) | ADRB2PARP1KDM4EDHODHHTT |
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-2005108374-A1 | INSECTICIDAL DIAZOLE AND TRIAZOLE DERIVATIVES | FMC CORPORATION (US) | 2005-11-17 | — | — | WO | disclosed |