Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 4/20 | 0.46 |
| ▸ | SCN1A | P35498 | 3/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13127966 | 0.85 | CHRM3 (0.43) | CHRM3SCN1ASCN2ASCN3AKMT2A | |
| SCHEMBL14501550 | 0.85 | EPHX1 (0.47) | CYP3A4TSHRCYP2C19DPP4EPHX1 | |
| SCHEMBL20147696 | 0.84 | HRH3 (0.42) | CYP3A4TSHRCYP2C19DPP4EPHX1 | |
| SCHEMBL21652040 | 0.84 | CYP3A4 (0.40) | CHRM3KMT2AMEN1CHRM5CYP3A4 | |
| SCHEMBL8243916 | 0.83 | EPHX1 (0.55) | KMT2AMEN1CYP3A4TSHRCYP2C19 | |
| SCHEMBL8395605 | 0.83 | EPHX1 (0.50) | KMT2AMEN1CYP3A4TSHRCYP2C19 | |
| SCHEMBL10150974 | 0.81 | CHRM4 (0.40) | CHRM3CHRM4CYP3A4TSHRCYP2C19 | |
| SCHEMBL22856991 | 0.81 | CYP3A4 (0.39) | CHRM3KMT2AMEN1CYP3A4TSHR | |
| SCHEMBL25567992 | 0.81 | MAOB (0.40) | CHRM3KMT2AMEN1CYP3A4TSHR | |
| SCHEMBL11153395 | 0.81 | EPHX1 (0.58) | KMT2AMEN1CYP3A4TSHRCYP2C19 |
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-2018071454-A1 | SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS | ANDREWS STEVEN W (US) | 2018-04-19 | — | — | WO | disclosed |