Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | GMNN | O75496 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CETP | P11597 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | UBE2N | P61088 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL5275864 | 1.00 | SPHK1 (0.59) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL1553302 | 1.00 | SPHK1 (0.59) | SPHK1CYP2D6LMNATP53GMNN | |
| Myristic Acid SCHEMBL4271771 | 0.86 | FFAR4 (0.62) | MAPTGPR84FFAR1 | |
| Decanoic Acid SCHEMBL4271763 | 0.86 | FFAR4 (0.62) | MAPTGPR84FFAR1 | |
| SCHEMBL14838294 | 0.84 | SPHK1 (0.53) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL14830567 | 0.84 | SPHK1 (0.53) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL14831503 | 0.84 | SPHK1 (0.53) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL14830334 | 0.84 | SPHK1 (0.53) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL10441289 | 0.80 | SPHK1 (0.54) | SPHK1CYP2D6LMNATP53GMNN | |
| SCHEMBL28238060 | 0.79 | SPHK1 (0.53) | SPHK1CYP2D6LMNATP53GMNN |
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-2014118556-A2 | SELECTIVE INHIBITORS AND ALLOSTERIC ACTIVATORS OF SPHINGOSINE KINASE | RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) | 2014-08-07 | — | — | WO | disclosed |