Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 8/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30516679 | 0.86 | KDM4E (0.44) | DPP4HRH3CYP1A2S1PR1MAOA | |
| SCHEMBL25192949 | 0.83 | MAPT (0.51) | DPP4HRH3CYP1A2POLB | |
| SCHEMBL24359587 | 0.81 | HRH3 (0.45) | DPP4HRH3S1PR1MAOAMAOB | |
| SCHEMBL23842183 | 0.81 | DPP4 (0.40) | DPP4HRH3CYP1A2S1PR1MAOA | |
| SCHEMBL24508492 | 0.81 | RORC (0.40) | HRH3ESR1CHRM4 | |
| SCHEMBL23696638 | 0.81 | DPP4 (0.40) | DPP4HRH3 | |
| SCHEMBL15037944 | 0.80 | DPP4 (0.60) | DPP4HRH3CHRM2CHRM4HTR1A | |
| SCHEMBL26845651 | 0.79 | ESR1 (0.38) | HRH3CYP1A2HPGDESR1 | |
| SCHEMBL26845653 | 0.79 | ESR1 (0.38) | HRH3CYP1A2HPGDESR1 | |
| SCHEMBL22794821 | 0.76 | KDM4E (0.46) | HRH3MAOAMAOB |
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-2020264490-A1 | IRAK DEGRADERS AND USES THEREOF | KYMERA THERAPEUTICS, INC. (US) | 2020-12-30 | — | — | WO | disclosed |