Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.49 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8930521 | 0.80 | GFER (0.36) | ALDH1A1MAPTKDM4ETDP1HPGD | |
| SCHEMBL5717885 | 0.78 | SIGMAR1 (0.45) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL4581656 | 0.78 | KDM4E (0.44) | KCNJ1KCNH2ALDH1A1KDM4ETDP1 | |
| Hydrochloric Acid SCHEMBL5849112 | 0.77 | SIGMAR1 (0.44) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL8930599 | 0.74 | TP53 (0.34) | CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8444134 | 0.73 | CYP19A1 (0.49) | ALDH1A1MAPTKDM4ETDP1HPGD | |
| SCHEMBL7536787 | 0.72 | FFAR1 (0.41) | KMT2AL3MBTL1LMNA | |
| SCHEMBL7544912 | 0.72 | CYP4A11 (0.38) | KCNJ1KCNH2KMT2ALMNA | |
| SCHEMBL7538929 | 0.71 | AOC3 (0.37) | ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL7536716 | 0.71 | KMT2A (0.33) | KCNJ1KCNH2SLC6A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997014443-A1 | MAGNETICALLY LABELED CHEMOATTRACTANTS AS TARGETED CONTRAST AGENTS IN THE NMR IMAGING OF LIVING TISSUES | BRACCO INTERNATIONAL B.V. (NL) | 1997-04-24 | — | — | WO | disclosed |
| CN-1069027-A | Aminocarboxylate ligands with substituted aromatic amide moieties | SQUIBB & SONS INC (US) | 1993-02-17 | — | — | CN | disclosed |