Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 7/20 | 0.41 |
| ▸ | GRM5 | P41594 | 6/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.40 |
| ▸ | GABRE | P78334 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21590284 | 0.96 | JAK1 (0.43) | HTR6JAK1BTKGRM1GRM5 | |
| SCHEMBL28503231 | 0.78 | JAK1 (0.56) | JAK1BTKGRM1GRM5CYP11B2 | |
| SCHEMBL28507487 | 0.75 | MAP4K1 (0.51) | JAK1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28503257 | 0.75 | CAMKK2 (0.42) | BTKRET | |
| SCHEMBL27025890 | 0.75 | GRM1 (0.51) | HTR6JAK1BTKGRM1GRM5 | |
| SCHEMBL28500725 | 0.74 | MAP4K1 (0.42) | RET | |
| SCHEMBL20112166 | 0.74 | PDK4 (0.58) | HTR6JAK1GRM1GRM5PDK4 | |
| SCHEMBL16434777 | 0.73 | GRM1 (0.56) | HTR6JAK1GRM1GRM5PDK4 | |
| SCHEMBL31222903 | 0.73 | NAMPT (0.54) | HTR6GRM1GRM5CYP11B2PDK4 | |
| SCHEMBL23306173 | 0.72 | NAMPT (0.55) | BTKGRM1GRM5CYP11B2PDK4 |
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 |