Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL19396020 | 0.88 | TAAR1 (0.46) | ALDH1A1TAAR1KCNJ1KCNH2CA2 | |
| SCHEMBL901008 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KCNH2CA2LMNA | |
| SCHEMBL2724731 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KCNH2CA2LMNA | |
| SCHEMBL904232 | 0.84 | ALDH1A1 (0.43) | ALDH1A1TAAR1KCNJ1MEN1KMT2A | |
| SCHEMBL11551629 | 0.80 | KCNJ1 (0.50) | ALDH1A1TAAR1KCNJ1KCNH2SMN1; SMN2 | |
| SCHEMBL11560785 | 0.80 | CYP1A2 (0.44) | ALDH1A1TAAR1KCNJ1SMN1; SMN2MEN1 | |
| SCHEMBL509775 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KCNH2CA2SMN1; SMN2LMNA | |
| SCHEMBL27541590 | 0.80 | TAAR1 (0.43) | ALDH1A1TAAR1KCNJ1KCNH2CA2 | |
| SCHEMBL9356418 | 0.80 | IGF1R (0.47) | ALDH1A1TAAR1KCNJ1KCNH2MEN1 | |
| SCHEMBL27765863 | 0.80 | ESR1 (0.50) | ALDH1A1TAAR1CA2TSHRLMNA |
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-2011159870-A9 | METHODS AND COMPOUNDS FOR THE PREPARATION OF FLUORINE-LABELED DEOXY-FTY720 | BRACCO IMAGING S.P.A. (IT) | 2012-04-12 | — | — | WO | disclosed |
| WO-2011159870-A1 | METHODS AND COMPOUNDS FOR THE PREPARATION OF FLUORINE-LABELED DEOXY-FTY720 | BRACCO IMAGING S.P.A. (IT) | 2011-12-22 | — | — | WO | disclosed |