Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.51 |
| ▸ | CDK4 | P11802 | 7/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.41 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.37 |
| ▸ | CCND1 | P24385 | 6/20 | 0.36 |
| ▸ | CCND3 | P30281 | 5/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | CDK9 | P50750 | 2/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CCNH | P51946 | 1/20 | 0.36 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20038005 | 0.82 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL18291536 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL20037516 | 0.80 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL20249262 | 0.79 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL21414444 | 0.79 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL20203434 | 0.79 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL21414350 | 0.75 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL255543 | 0.73 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3CDK4CDK6 | |
| SCHEMBL21017102 | 0.73 | TYK2 (0.48) | MAP4K1F10 | |
| SCHEMBL158236 | 0.72 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CDK4CDK6 |
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 |