Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.59 |
| ▸ | HRH1 | P35367 | 2/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.51 |
| ▸ | CCR2 | P41597 | 1/20 | 0.51 |
| ▸ | UBE2N | P61088 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 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 | |
|---|---|---|---|---|
| SCHEMBL22323130 | 0.87 | HTR2A (0.62) | HTR2AHRH1CCR2UBE2NCHRM1 | |
| Hydrochloric Acid SCHEMBL22323080 | 0.85 | HTR2A (0.61) | HTR2AHRH1CCR2UBE2NCHRM1 | |
| SCHEMBL10574777 | 0.84 | HTR2A (0.59) | HTR2AHRH1CCR2UBE2NCHRM1 | |
| Hydrochloric Acid SCHEMBL22323079 | 0.84 | HTR2A (0.59) | HTR2AHRH1CCR2UBE2NCHRM1 | |
| SCHEMBL14798226 | 0.83 | HTR2A (0.44) | HTR2AHRH1EPHX1CCR2UBE2N | |
| SCHEMBL14798442 | 0.82 | ALDH1A1 (0.44) | HTR2AHRH1EPHX1CCR2UBE2N | |
| SCHEMBL528414 | 0.81 | EPHX1 (0.56) | EPHX1ALOX5KDM4EALDH1A1LMNA | |
| SCHEMBL4903496 | 0.81 | PTGS1 (0.47) | HTR2AHRH1CCR2UTS2RKDM4E | |
| SCHEMBL10573773 | 0.81 | CCR2 (0.58) | HTR2AHRH1CCR2UBE2NCHRM1 | |
| SCHEMBL3820588 | 0.81 | EPHX1 (0.55) | HTR2AEPHX1CHRM1ALOX5LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3921317-A1 | 3-AMINO-2-[2-(ACYLAMINO)PYRIDIN-4-YL]-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE AS CSNK1 INHIBITORS | Bayer Aktiengesellschaft (DE) | 2021-12-15 | — | — | EP | claimed |
| WO-2020161257-A1 | 3-AMINO-2-[2-(ACYLAMINO)PYRIDIN-4-YL]-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE AS CSNK1 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2020-08-13 | — | — | WO | claimed |