Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.55 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.55 |
| ▸ | CES2 | O00748 | 4/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.43 |
| ▸ | PPARG | P37231 | 7/20 | 0.43 |
| ▸ | PPARD | Q03181 | 7/20 | 0.43 |
| ▸ | PPARA | Q07869 | 7/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11841855 | 0.97 | SPHK2 (0.57) | SPHK2SPHK1CES2CES1AKR1B1 | |
| SCHEMBL22828746 | 0.94 | SPHK2 (0.62) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL28061608 | 0.94 | SPHK2 (0.62) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL16300178 | 0.94 | SPHK2 (0.62) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL19266112 | 0.94 | SPHK2 (0.62) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL28769713 | 0.94 | SPHK2 (0.62) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL27550098 | 0.91 | SPHK2 (0.52) | SPHK2SPHK1CES2CES1AKR1B1 | |
| SCHEMBL22430447 | 0.88 | SPHK2 (0.56) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL21993462 | 0.88 | SPHK2 (0.56) | SPHK2SPHK1CES2CES1TSHR | |
| SCHEMBL10604788 | 0.88 | SPHK2 (0.56) | SPHK2SPHK1CES2CES1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007011910-A2 | CHIRAL AMINE-CATALYZED ASYMMETRIC ADDITION OF CARBON-CENTERED NUCLEOPHILES TO IMINES | TRUSTEES OF BOSTON UNIVERSITY (US) | 2007-01-25 | — | — | WO | disclosed |