Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 6/20 | 0.47 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 2/20 | 0.40 |
| ▸ | JAK1 | P23458 | 2/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL9906713 | 0.88 | CXCR4 (0.46) | SPHK2SPHK1CXCR4HRH3JAK2 | |
| SCHEMBL13540688 | 0.84 | SPHK2 (0.50) | SPHK2SPHK1CXCR4ALDH1A1LMNA | |
| SCHEMBL9906715 | 0.82 | POLB (0.51) | SPHK2SPHK1KMT2AMEN1ALDH1A1 | |
| SCHEMBL9906699 | 0.80 | SPHK2 (0.57) | SPHK2SPHK1HRH3 | |
| SCHEMBL3637783 | 0.78 | KMT2A (0.64) | CXCR4KMT2AMEN1ALDH1A1JAK2 | |
| SCHEMBL9906696 | 0.78 | TSHR (0.52) | SPHK1CXCR4KMT2AMEN1TSHR | |
| SCHEMBL11371632 | 0.77 | CHI3L1 (0.43) | SPHK2SPHK1HRH3ALDH1A1KCNH2 | |
| SCHEMBL13540715 | 0.75 | KMT2A (0.58) | CXCR4KMT2AMEN1ALDH1A1JAK2 | |
| SCHEMBL14045602 | 0.75 | POLB (0.45) | SPHK2SPHK1JAK2JAK1TYK2 | |
| SCHEMBL8587272 | 0.75 | POLB (0.45) | SPHK2SPHK1JAK2JAK1TYK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7652039-B2 | Such as 1-(2-((3-(4-chlorophenoxy)benzyl)amino)-3-phenyl-propyl)piperidin-4-ol for treatment of tuberculosis; solid phase synthesis | SEQUELLA, INC. (US) | 2010-01-26 | — | — | US | disclosed |