Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 13/20 | 0.38 |
| ▸ | HTR2C | P28335 | 13/20 | 0.38 |
| ▸ | HTR2A | P28223 | 12/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29966331 | 0.85 | PARP1 (0.46) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL29966514 | 0.85 | PARP1 (0.46) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL26625271 | 0.85 | PARP1 (0.46) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL30702597 | 0.82 | PARP1 (0.40) | PARP1HTR2BHTR2CHTR2AALDH1A1 | |
| SCHEMBL30002807 | 0.81 | PARP1 (0.44) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL30595369 | 0.80 | PARP1 (0.42) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL32664871 | 0.80 | PARP1 (0.41) | PARP1HTR2BHTR2CHTR2AHTR3E | |
| SCHEMBL30635212 | 0.80 | HTR2C (0.41) | PARP1HTR2BHTR2CHTR2AMEN1 | |
| SCHEMBL30635240 | 0.80 | HTR2C (0.41) | PARP1HTR2BHTR2CHTR2AMEN1 | |
| SCHEMBL30351677 | 0.79 | PARP1 (0.43) | PARP1HTR2BHTR2CHTR2AHTR3E |
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 |