Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 8/20 | 0.51 |
| ▸ | HTR1A | P08908 | 6/20 | 0.51 |
| ▸ | RARB | P10826 | 4/20 | 0.50 |
| ▸ | RARA | P10276 | 3/20 | 0.50 |
| ▸ | RARG | P13631 | 3/20 | 0.50 |
| ▸ | USP2 | O75604 | 6/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL8515143 | 0.89 | HTR7 (0.60) | HTR7HTR1ARARBRARARARG | |
| SCHEMBL8514584 | 0.80 | RARB (0.56) | RARBRARARARGUSP2HSD17B10 | |
| Trifluoroacetic Acid SCHEMBL2223859 | 0.78 | RAB9A (0.47) | RARBRARARARGUSP2ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL8537644 | 0.78 | HRH4 (0.43) | RARBRARARARGRXRA | |
| Trifluoroacetic Acid SCHEMBL8511757 | 0.77 | RARB (0.40) | RARBRARARARGRXRA | |
| SCHEMBL17027133 | 0.76 | RARB (0.57) | RARBRARARARGUSP2HSD17B10 | |
| Trifluoroacetic Acid SCHEMBL8511708 | 0.75 | HDAC1 (0.39) | RARBRARARARGUSP2HSD17B10 | |
| SCHEMBL17027247 | 0.75 | RARA (0.56) | RARBRARARARGUSP2HSD17B10 | |
| SCHEMBL9612698 | 0.75 | TGFBR1 (0.48) | HTR7 | |
| SCHEMBL2223691 | 0.75 | ADRB1 (0.53) | HTR7HTR1ACYP1A2CYP2D6CYP3A4 |
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-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |