Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 5/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 5/20 | 0.32 |
| ▸ | NTRK3 | Q16288 | 5/20 | 0.32 |
| ▸ | NTRK2 | Q16620 | 5/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16621078 | 0.89 | PIK3CA (0.32) | CSNK1DPRKCAPRKCIPRKCETGFBR1 | |
| SCHEMBL24520056 | 0.88 | PIK3CA (0.31) | CSNK1DPIK3CA | |
| SCHEMBL16620670 | 0.81 | MKNK1 (0.49) | PIK3CA | |
| SCHEMBL16620931 | 0.81 | MKNK1 (0.49) | NTRK3PIK3CA | |
| SCHEMBL29756308 | 0.81 | MKNK1 (0.49) | NTRK3PIK3CA | |
| SCHEMBL17969545 | 0.73 | PRKCI (0.37) | CSNK1DRPS6KA3PRKCAPRKCIPRKCE | |
| SCHEMBL24520037 | 0.71 | PRKCI (0.36) | RPS6KA3PRKCAPRKCIPRKCENTRK3 | |
| SCHEMBL24520074 | 0.71 | CSNK1D (0.35) | CSNK1DTGFBR1PIK3CAPRMT5WDR77 | |
| SCHEMBL18012832 | 0.71 | MKNK1 (0.51) | NTRK3 | |
| SCHEMBL16626035 | 0.65 | MKNK1 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3052501-B1 | BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF | AGENCY SCIENCE TECH & RES (SG) | 2022-06-22 | — | — | EP | disclosed |