Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 4/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | NPY1R | P25929 | 1/20 | 0.53 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6791530 | 0.87 | ALDH1A1 (0.68) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL1928807 | 0.85 | CYP1A2 (0.67) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL9927436 | 0.84 | ALDH1A1 (0.68) | TPSAB1ALDH1A1NPY1RNPY5RCYP1A2 | |
| Hydrochloric Acid SCHEMBL1846589 | 0.84 | CYP1A2 (0.66) | TPSAB1ALDH1A1NPY1RNPY5RCYP1A2 | |
| Hydrochloric Acid SCHEMBL6863251 | 0.83 | ALDH1A1 (0.67) | TPSAB1ALDH1A1NPY1RNPY5RCYP1A2 | |
| SCHEMBL6371275 | 0.82 | TPSAB1 (1.00) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL6370836 | 0.81 | ALDH1A1 (0.64) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL14516830 | 0.81 | NPY1R (0.67) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL29141944 | 0.80 | TPSAB1 (0.61) | TPSAB1ALDH1A1NPY1RNPY5RLMNA | |
| SCHEMBL3685286 | 0.78 | ALDH1A1 (0.68) | ALDH1A1NPY1RNPY5RLMNAGAA |
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-6255323-B1 | Cyanoguanidine compounds | SHIONOGI BIORESEARCH CORP. | 2001-07-03 | — | — | US | disclosed |
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |