Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8790515 | 0.95 | SIGMAR1 (0.41) | SIGMAR1GAAL3MBTL1MAPTALDH1A1 | |
| SCHEMBL1022743 | 0.90 | SIGMAR1 (0.44) | SIGMAR1GAAL3MBTL1MAPTALDH1A1 | |
| SCHEMBL6532984 | 0.83 | SIGMAR1 (0.47) | SIGMAR1GAAL3MBTL1ALDH1A1TSHR | |
| SCHEMBL6272610 | 0.80 | SIGMAR1 (0.52) | SIGMAR1GAAL3MBTL1MAPTALDH1A1 | |
| SCHEMBL8329624 | 0.79 | HRH3 (0.46) | MAPTALDH1A1HRH3LMNA | |
| SCHEMBL18768681 | 0.78 | SIGMAR1 (0.53) | SIGMAR1GAAL3MBTL1ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL1023667 | 0.72 | ALDH1A1 (0.41) | GAAL3MBTL1MAPTALDH1A1MEN1 | |
| SCHEMBL14423336 | 0.72 | SIGMAR1 (0.55) | SIGMAR1GAAALDH1A1TSHRMEN1 | |
| Pyrrolidine SCHEMBL15516038 | 0.69 | SIGMAR1 (0.72) | SIGMAR1ALDH1A1TSHRMEN1CYP2C9 | |
| SCHEMBL28265665 | 0.68 | MEN1 (0.36) | L3MBTL1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0813523-A2 | PREPARATION OF N-ARYLMETHYL AZIRIDINE DERIVATIVES, 1,4,7,10-TETRAAZACYCLODODECANE DERIVATIVES OBTAINED THEREFROM AND N-ARYLMETHYL-ETHANOL-AMINE SULPHONATE ESTERS AS INTERMEDIATES | NYCOMED SALUTAR, INC. (US) | 1997-12-29 | — | — | EP | disclosed |
| WO-1996028420-A2 | PREPARATION OF N-ARYLMETHYL AZIRIDINE DERIVATIVES, 1,4,7,10-TETRAAZACYCLODODECANE DERIVATIVES OBTAINED THEREFROM AND N-ARYLMETHYL-ETHANOL-AMINE SULPHONATE ESTERS AS INTERMEDIATES | NYCOMED SALUTAR, INC. (US) | 1996-09-19 | — | — | WO | disclosed |