Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL9740561 | 0.94 | CHRNB2 (0.49) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Hydrochloric Acid SCHEMBL9739064 | 0.93 | CHRNB2 (0.48) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9746442 | 0.91 | CHRNB2 (0.46) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL9740942 | 0.91 | CCR2 (0.52) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9742193 | 0.91 | HCN4 (0.52) | KCNH2GAAMEN1KMT2AMAPT | |
| SCHEMBL9739855 | 0.91 | CHRNB2 (0.46) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9740796 | 0.90 | CHRNB2 (0.45) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9739409 | 0.90 | CHRNB2 (0.47) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9740124 | 0.87 | HCN4 (0.51) | GAAMEN1KMT2AMAPTHCN4 | |
| SCHEMBL9740542 | 0.86 | GAA (0.42) | CCR2CHRNB2CHRNB4CHRNA3CHRNA4 |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0224794-A2 | Cyclic amine derivatives, medicines containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1987-06-10 | — | — | EP | disclosed |