Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 12/20 | 0.33 |
| ▸ | RARA | P10276 | 10/20 | 0.33 |
| ▸ | RARB | P10826 | 10/20 | 0.33 |
| ▸ | RARG | P13631 | 10/20 | 0.33 |
| ▸ | RXRB | P28702 | 5/20 | 0.32 |
| ▸ | RXRG | P48443 | 5/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12633332 | 0.73 | RXRA (0.41) | RXRARARARARBRARGRXRB | |
| SCHEMBL25367430 | 0.72 | RXRA (0.42) | RXRARARARARBRARGRXRB | |
| SCHEMBL18741106 | 0.67 | RXRA (0.46) | RXRARARARARBRARGRXRB | |
| SCHEMBL31084998 | 0.66 | NPC1 (0.50) | RXRARARARARBRARGRXRB | |
| SCHEMBL18740981 | 0.66 | NPC1 (0.50) | RXRARARARARBRARGRXRB | |
| SCHEMBL11489025 | 0.65 | RXRA (0.69) | RXRARARARARBRARGRXRB | |
| SCHEMBL11489029 | 0.65 | RXRA (0.69) | RXRARARARARBRARGRXRB | |
| SCHEMBL11489028 | 0.65 | RXRA (0.69) | RXRARARARARBRARGRXRB | |
| SCHEMBL25369126 | 0.64 | RXRA (0.41) | RXRARARARARBRARGRXRB | |
| SCHEMBL18408430 | 0.62 | NOTUM (0.43) | NPC1ALDH1A1LMNATP53CYP3A4 |
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-2011072791-A1 | SPHINGOSINE KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2011-06-23 | — | — | WO | disclosed |