Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.46 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.46 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.46 |
| ▸ | GPR183 | P32249 | 1/20 | 0.46 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | TACR2 | P21452 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2723128 | 0.82 | TNNC1 (0.50) | KCNH2TNNC1S1PR1S1PR4S1PR3 | |
| SCHEMBL10036574 | 0.80 | S1PR1 (0.56) | KCNH2TNNC1S1PR1S1PR4S1PR3 | |
| SCHEMBL903515 | 0.75 | S1PR1 (0.61) | KCNH2TNNC1S1PR1S1PR4S1PR3 | |
| SCHEMBL903609 | 0.73 | PPARG (0.46) | KCNH2TNNC1S1PR1S1PR4S1PR3 | |
| SCHEMBL25171490 | 0.72 | KCNH2 (0.77) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL8743949 | 0.72 | KCNH2 (0.77) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL4310058 | 0.72 | KCNH2 (0.77) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL4190401 | 0.72 | KCNH2 (0.77) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL6678908 | 0.72 | KCNH2 (0.77) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL2724731 | 0.72 | ALDH1A1 (0.61) | KCNH2FAAHESR1ADRA2AADORA3 |
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 |