Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8117208 | 0.99 | S1PR1 (0.39) | S1PR1HTR2AHTR2CSLC9A1CFTR | |
| Hydrochloric Acid SCHEMBL7805318 | 0.90 | TNFSF11 (0.40) | S1PR1SLC9A1ALDH1A1LRRK2CYP2C9 | |
| SCHEMBL7801887 | 0.89 | APP (0.39) | S1PR1SLC9A1CFTRLRRK2CYP2C9 | |
| SCHEMBL8428710 | 0.88 | MAPT (0.40) | S1PR1HTR2AHTR2CLRRK2MAPT | |
| Hydrochloric Acid SCHEMBL8335173 | 0.87 | MAPT (0.40) | S1PR1HTR2AHTR2CLRRK2MAPT | |
| SCHEMBL8116932 | 0.80 | MAPT (0.47) | CFTRMAPTKDM4E | |
| Hydrochloric Acid SCHEMBL8102752 | 0.78 | MAPT (0.46) | CFTRMAPT | |
| SCHEMBL8102763 | 0.77 | CFTR (0.49) | HTR2AHTR2CCFTRALDH1A1MAPT | |
| SCHEMBL1763883 | 0.77 | SLC9A1 (0.69) | HTR2ASLC9A1CYP2C9CYP2C19 | |
| SCHEMBL5874056 | 0.76 | ALDH1A1 (0.50) | HTR2AHTR2CALDH1A1KDM4ECYP2C19 |
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-6153651-A | Ortho-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-11-28 | — | — | US | claimed |