Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 17/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | CCR3 | P51677 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL9923328 | 0.81 | MC4R (0.72) | MC4RCHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL14593276 | 0.76 | MC4R (0.69) | MC4RCCR3CHRM2CHRM4CHRM5 | |
| SCHEMBL11112394 | 0.73 | MC4R (0.38) | MC4RCCR3CHRM2CHRM4CHRM5 | |
| SCHEMBL1160038 | 0.71 | DPP4 (0.68) | MC4RCHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL19414179 | 0.69 | MAPT (0.52) | MC4R | |
| SCHEMBL25375773 | 0.68 | MC4R (0.62) | MC4RCCR3CHRM2CHRM4CHRM5 | |
| SCHEMBL2843665 | 0.68 | MC4R (0.62) | MC4RCCR3CHRM2CHRM4CHRM5 | |
| SCHEMBL27921963 | 0.68 | CYP1A2 (0.38) | CYP2D6SLC6A3KCNH2 | |
| SCHEMBL12875000 | 0.68 | MC4R (0.65) | MC4RCCR3CHRM2CHRM4CHRM5 | |
| SCHEMBL2962625 | 0.67 | OPRM1 (0.65) | MC4RCCR3CHRM2CHRM4CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |