Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 11/20 | 0.34 |
| ▸ | ACACA | Q13085 | 11/20 | 0.34 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.32 |
| ▸ | GPR183 | P32249 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30801274 | 0.83 | PTK6 (0.34) | MAPK14ACACBACACAPTK6KCNH2 | |
| SCHEMBL30801166 | 0.75 | SPR (0.35) | SPR | |
| SCHEMBL30066339 | 0.74 | KDM4E (0.39) | MAPK14 | |
| SCHEMBL24670722 | 0.73 | ITK (0.51) | PTK6PIK3CAMTORPIK3CG | |
| SCHEMBL30066458 | 0.73 | ITK (0.51) | PTK6PIK3CAMTORPIK3CG | |
| SCHEMBL30066295 | 0.69 | GHSR (0.54) | MAPK14ACACA | |
| SCHEMBL1019313 | 0.64 | PTK6 (0.45) | PTK6PIK3CAMTORPIK3CG | |
| SCHEMBL29990522 | 0.62 | ITK (0.53) | GPR183 | |
| SCHEMBL24670928 | 0.62 | ITK (0.53) | GPR183 | |
| SCHEMBL18019029 | 0.62 | CA12 (0.46) | PTK6PIK3CAMTORPIK3CGMGLL |
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 |
|---|---|---|---|---|---|---|---|
| CN-117693502-A | Compounds for inhibiting or degrading ITK, compositions comprising the same, methods of making the same, and methods of using the same | 纽力克斯治疗公司 | 2024-03-12 | — | — | CN | disclosed |