Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 2/20 | 0.38 |
| ▸ | WNT3A | P56704 | 2/20 | 0.38 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.38 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 4/20 | 0.36 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 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 | |
|---|---|---|---|---|
| SCHEMBL30801218 | 0.80 | ITK (0.48) | CTNNB1WNT3AMAP2K4MAPK1MAPKAPK3 | |
| SCHEMBL30801295 | 0.80 | ITK (0.51) | CTNNB1WNT3AMAP2K4MAPK1MAPKAPK3 | |
| SCHEMBL2880089 | 0.73 | PRKD3 (0.42) | MAPK10ITKRAB9ANPC1TP53 | |
| SCHEMBL30801175 | 0.69 | GRM4 (0.41) | ITKMAPTFLT3 | |
| SCHEMBL30801308 | 0.69 | MAPK10 (0.55) | MAP2K4MAPK6MAPK10ITKBTK | |
| SCHEMBL16720663 | 0.67 | KDM4E (0.36) | CTNNB1WNT3AMAPK10ITKRAB9A | |
| SCHEMBL30801205 | 0.67 | SMO (0.40) | MAP2K4MAPK6MAPK10ITKBTK | |
| SCHEMBL20027771 | 0.65 | MAP2K4 (0.43) | CTNNB1WNT3AMAP2K4MAPK1MAPKAPK3 | |
| SCHEMBL6669514 | 0.65 | FGFR1 (0.61) | MAP2K4MAPK1MAPKAPK3MAPK6ITK | |
| SCHEMBL2610321 | 0.65 | KCNH2 (0.47) | MAPTRAB9ASMN1; SMN2HSD17B10NPC1 |
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 |