Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6423403 | 0.88 | GAA (0.37) | ALDH1A1GAASLC6A9KMT2AKDM4E | |
| SCHEMBL6421089 | 0.80 | HSD17B10 (0.34) | TSHRALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2909450 | 0.77 | SIGMAR1 (0.36) | TSHRALDH1A1GAAHSD17B10SLC6A9 | |
| SCHEMBL24220960 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 | |
| SCHEMBL1133814 | 0.74 | — | — | |
| SCHEMBL14100030 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 | |
| SCHEMBL3967181 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 | |
| SCHEMBL7744888 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 | |
| SCHEMBL13223389 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 | |
| SCHEMBL1165366 | 0.74 | SLC6A9 (0.40) | ALDH1A1CYP1A2CYP2D6KCNH2HRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047677-B1 | Process for the preparation of derivatives of 1,4,7,10-tetraazacyclododecane-1,4-diacetic acid | BRACCO SPA (IT) | 2005-07-20 | — | — | EP | claimed |
| EP-1047677-B1 | Process for the preparation of derivatives of 1,4,7,10-tetraazacyclododecane-1,4-diacetic acid | BRACCO SPA (IT) | 2005-07-20 | — | — | EP | disclosed |
| US-6342597-B1 | CONDENSATION REACTION TRIETHYLENETETRAMINE WITH GLYOXAL TO CYCLIZE; OXIDATION, ALKYLATION, HYDROLYSIS, QUATERNIZATION; NUCLEAR MAGNETIC RESONANCE IMAGING | DIBRA S.P.A. (IT) | 2002-01-29 | — | — | US | disclosed |