Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TGM2 | P21980 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19145310 | 0.72 | SMN1; SMN2 (0.44) | SMN1; SMN2TAS2R38HSD17B10NAPRTCYP1A2 | |
| SCHEMBL11144243 | 0.71 | TAS2R38 (0.44) | SMN1; SMN2TAS2R38HSD17B10NAPRTCXCR4 | |
| SCHEMBL22606375 | 0.71 | CXCR4 (0.39) | SMN1; SMN2TAS2R38HSD17B10NAPRTCXCR4 | |
| SCHEMBL2914537 | 0.71 | NAPRT (0.52) | SMN1; SMN2HSD17B10NAPRTCYP1A2NPSR1 | |
| SCHEMBL14543949 | 0.67 | SMN1; SMN2 (0.35) | SMN1; SMN2TAS2R38HSD17B10NAPRTTP53 | |
| SCHEMBL11183534 | 0.64 | MTOR (0.47) | SMN1; SMN2HSD17B10NAPRTCYP1A2NPSR1 | |
| SCHEMBL5157140 | 0.64 | TAS2R38 (0.52) | SMN1; SMN2TAS2R38HSD17B10NAPRTCYP1A2 | |
| SCHEMBL18676955 | 0.64 | TAS2R38 (0.52) | SMN1; SMN2TAS2R38HSD17B10NAPRTCYP1A2 | |
| SCHEMBL13513997 | 0.63 | NPC1 (0.53) | SMN1; SMN2HSD17B10NAPRTCYP1A2NPSR1 | |
| SCHEMBL12113186 | 0.62 | MAPT (0.61) | SMN1; SMN2TAS2R38HSD17B10NAPRTTP53 |
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-2017019804-A2 | COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2017-02-02 | — | — | WO | disclosed |