Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A12 | P48065 | 5/20 | 0.40 |
| ▸ | SLC6A11 | P48066 | 5/20 | 0.40 |
| ▸ | SLC6A13 | Q9NSD5 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3891585 | 0.96 | SLC6A12 (0.40) | SLC6A12SLC6A11SLC6A13CYP1A2CYP2D6 | |
| SCHEMBL8286003 | 0.86 | SLC6A12 (0.43) | SLC6A12SLC6A11SLC6A13HSD11B1ALDH1A1 | |
| SCHEMBL29697589 | 0.82 | SLC6A12 (0.50) | SLC6A12SLC6A11SLC6A13HSD11B1ALDH1A1 | |
| SCHEMBL1925986 | 0.79 | SLC6A12 (0.52) | SLC6A12SLC6A11SLC6A13HSD11B1ALDH1A1 | |
| SCHEMBL19052677 | 0.79 | SLC6A12 (0.45) | SLC6A12SLC6A11SLC6A13CYP1A2CYP2D6 | |
| SCHEMBL19052976 | 0.79 | SLC6A12 (0.45) | SLC6A12SLC6A11SLC6A13CYP1A2CYP2D6 | |
| SCHEMBL19052820 | 0.79 | SLC6A12 (0.45) | SLC6A12SLC6A11SLC6A13CYP1A2CYP2D6 | |
| SCHEMBL3800385 | 0.78 | SLC6A12 (0.39) | SLC6A12SLC6A11SLC6A13HSD11B1ALDH1A1 | |
| SCHEMBL1712935 | 0.77 | CYP1A2 (0.36) | CYP1A2CYP2D6 | |
| SCHEMBL7786723 | 0.75 | CYP2D6 (0.37) | CYP1A2CYP2D6HSD11B1ALDH1A1HSD11B2 |
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-0920411-A1 | DIAGNOSTIC IMAGING CONTRAST AGENT WITH IMPROVED IN-SERUM-RELAXIVITY | BRACCO S.p.A. (IT) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998005626-A1 | DIAGNOSTIC IMAGING CONTRAST AGENT WITH IMPROVED IN-SERUM-RELAXIVITY | BRACCO S.P.A. (IT) | 1998-02-12 | — | — | WO | disclosed |