Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | IDH1 | O75874 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL9205094 | 0.89 | KDM4E (0.40) | SIGMAR1 | |
| SCHEMBL9740252 | 0.84 | KMT2A (0.38) | DRD4 | |
| SCHEMBL9739252 | 0.79 | KMT2A (0.42) | — | |
| SCHEMBL9207731 | 0.78 | SIGMAR1 (0.43) | SIGMAR1DRD4HTR1A | |
| SCHEMBL9213470 | 0.77 | LMNA (0.37) | SIGMAR1 | |
| SCHEMBL9213658 | 0.75 | ALDH1A1 (0.41) | SIGMAR1IDH1 | |
| SCHEMBL9205886 | 0.75 | PRMT5 (0.51) | SIGMAR1 | |
| SCHEMBL9215245 | 0.73 | ALDH1A1 (0.41) | SIGMAR1DRD4 | |
| SCHEMBL9215547 | 0.73 | PRMT5 (0.44) | SIGMAR1 | |
| SCHEMBL19859652 | 0.72 | CYP2D6 (0.41) | DRD4 |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |