Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7270081 | 0.91 | SIGMAR1 (0.51) | PARP1SIGMAR1HTR1AALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL9871842 | 0.86 | SIGMAR1 (0.55) | PARP1SIGMAR1HTR1ADRD2 | |
| Hydrochloric Acid SCHEMBL9870487 | 0.83 | SIGMAR1 (0.57) | PARP1SIGMAR1HTR1AALDH1A1MAPT | |
| Cadaverine Tartrate SCHEMBL9870484 | 0.82 | CYP1A2 (0.46) | PARP1SIGMAR1HTR1AALDH1A1MAPT | |
| SCHEMBL10333960 | 0.81 | DRD4 (0.49) | PARP1SIGMAR1HTR1AALDH1A1DRD2 | |
| SCHEMBL7268941 | 0.81 | HSD17B10 (0.51) | SIGMAR1HTR1AALDH1A1MAPTDRD2 | |
| Hydrochloric Acid SCHEMBL9871774 | 0.80 | SIGMAR1 (0.49) | PARP1SIGMAR1ALDH1A1MAPTKDM4E | |
| SCHEMBL1302257 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPTKDM4EGAAPOLB | |
| Cadaverine Tartrate SCHEMBL9871114 | 0.74 | HTR1A (0.49) | SIGMAR1HTR1AALDH1A1KDM4EDRD2 | |
| SCHEMBL9872432 | 0.74 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EGAAPOLB |
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-5071864-A | Administering for high blood pressure and central nervous syst em disorders | BASF AKTIENGESELLSCHAFT (DE) | 1991-12-10 | — | — | US | disclosed |