Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CCNH | P51946 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18291456 | 0.85 | CHRNB2 (0.36) | GRM4CHRNB2CHRNA4RAB9ASMN1; SMN2 | |
| SCHEMBL20038045 | 0.84 | RAB9A (0.33) | ELANECHRNB2CHRNA4RAB9ASMN1; SMN2 | |
| SCHEMBL20038025 | 0.82 | ELANE (0.46) | ELANEDRD3KCNH2GRM4CHRNB2 | |
| SCHEMBL20249234 | 0.82 | OPRL1 (0.34) | ELANERAB9ASMN1; SMN2PIK3CDAR | |
| SCHEMBL18096248 | 0.79 | AR (0.55) | ELANEDRD3CHRNB2CHRNA4AR | |
| SCHEMBL14490582 | 0.78 | DRD3 (0.44) | ELANEDRD3KCNH2CHRNB2CHRNA4 | |
| SCHEMBL18291196 | 0.77 | CDK4 (0.42) | ELANEDRD3KCNH2GRM4CHRNB2 | |
| SCHEMBL18291199 | 0.76 | EGLN1 (0.46) | ELANEDRD3KCNH2EGLN1CDK4 | |
| SCHEMBL19913872 | 0.75 | AR (0.39) | GRM4P2RX7EGLN1RAB9ASMN1; SMN2 | |
| SCHEMBL19913877 | 0.75 | AR (0.50) | GRM4EGLN1RAB9ASMN1; SMN2PIK3CD |
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 |