Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.49 |
| ▸ | HTR6 | P50406 | 4/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.49 |
| ▸ | HTR3B | O95264 | 3/20 | 0.49 |
| ▸ | HTR3A | P46098 | 3/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5240485 | 0.83 | KDM4E (0.46) | LMNAMAPT | |
| SCHEMBL28513873 | 0.80 | GAA (0.51) | HTR6DRD2CYP2C19DRD3MAPT | |
| SCHEMBL4190135 | 0.78 | HTR6 (0.61) | CHRNB2CHRNA4ADRB1HTR6HTR3E | |
| SCHEMBL4849552 | 0.78 | HTR3A (0.66) | ADRB1HTR6HTR3EHTR3BHTR3A | |
| SCHEMBL28905291 | 0.76 | ADRB1 (0.47) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL14009665 | 0.75 | HTR3E (0.68) | ADRB1HTR6HTR3EHTR3BHTR3A | |
| SCHEMBL14922246 | 0.75 | ADRB1 (0.45) | CHRNB2CHRNA4ADRB1HTR6HTR3E | |
| SCHEMBL19869933 | 0.75 | CYP1A2 (0.50) | CHRNB2CHRNA4ADRB1 | |
| SCHEMBL8250752 | 0.73 | ADRB1 (0.54) | CHRNB2CHRNA4ADRB1HTR6HTR3E | |
| SCHEMBL23798860 | 0.72 | PKM (0.50) | CHRNB2CHRNA4SIGMAR1LMNAHTR2C |
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-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |