Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | PRKD1 | Q15139 | 14/20 | 0.38 |
| ▸ | PRKD2 | Q9BZL6 | 13/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | PRKCG | P05129 | 1/20 | 0.34 |
| ▸ | PRKCB | P05771 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | PRKCA | P17252 | 1/20 | 0.34 |
| ▸ | PRKCH | P24723 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.34 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.34 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.34 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8510098 | 0.93 | IRAK4 (0.36) | IRAK4PRKD1PRKD2KARS1PRKD3 | |
| SCHEMBL8511070 | 0.86 | IRAK4 (0.48) | IRAK4PRKD3PRKCBPRKCABRD4 | |
| SCHEMBL9612709 | 0.83 | KMT2A (0.47) | PRKD1PRKD2KMT2AKARS1PRKD3 | |
| Trifluoroacetic Acid SCHEMBL8514001 | 0.78 | RARA (0.42) | IRAK4MAPK14 | |
| Trifluoroacetic Acid SCHEMBL8537644 | 0.75 | HRH4 (0.43) | PRKD1PRKD2KMT2APRKD3 | |
| SCHEMBL8512407 | 0.73 | ADRB1 (0.44) | KMT2AADRB1 | |
| Hydrochloric Acid SCHEMBL8512430 | 0.72 | ADRB1 (0.43) | KMT2AADRB1 | |
| SCHEMBL2016664 | 0.71 | DYRK1A (0.54) | PRKD1PRKD2KARS1PRKD3ADRB1 | |
| SCHEMBL8515571 | 0.70 | CYP1A2 (0.47) | PRKD1PRKD2KMT2APRKD3ADRB1 | |
| SCHEMBL8514909 | 0.70 | CYP1A2 (0.52) | DYRK1A |
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 | claimed |