Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | BPTF | Q12830 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.35 |
| ▸ | CDK4 | P11802 | 2/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | OGA | O60502 | 2/20 | 0.34 |
| ▸ | NNMT | P40261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23707258 | 0.82 | LTA4H (0.40) | CYP2D6OGA | |
| SCHEMBL18291593 | 0.80 | CHRM2 (0.48) | CHRM2CHRM1CYP2D6CYP19A1MEN1 | |
| SCHEMBL20255517 | 0.79 | CHRM2 (0.47) | CHRM2CHRM1CYP2D6CYP19A1MEN1 | |
| SCHEMBL24323620 | 0.79 | CHRM2 (0.47) | CHRM2CHRM1CYP2D6CYP19A1BPTF | |
| SCHEMBL18291412 | 0.79 | CHRM2 (0.47) | CHRM2CHRM1CYP2D6CYP19A1MEN1 | |
| SCHEMBL20249127 | 0.77 | CHRM2 (0.51) | CHRM2CHRM1CYP2D6CYP19A1MEN1 | |
| SCHEMBL20883792 | 0.72 | CHRM2 (0.59) | CHRM2CHRM1CYP2D6CYP19A1MEN1 | |
| SCHEMBL20038429 | 0.72 | CHRNB2 (0.58) | BPTFCDK4CCND1 | |
| SCHEMBL2611018 | 0.71 | HCAR3 (0.46) | MEN1KMT2AHCAR3NNMT | |
| SCHEMBL30233132 | 0.71 | KCNA5 (0.53) | CHRM2CHRM1CYP2D6MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3305785-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2018-04-11 | — | — | EP | disclosed |