Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 10/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL23995393 | 1.00 | NT5E (0.40) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23994610 | 1.00 | NT5E (0.40) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23995205 | 0.89 | NT5E (0.42) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23995204 | 0.89 | NT5E (0.42) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23994694 | 0.88 | NT5E (0.40) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23993490 | 0.84 | KDM4E (0.40) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23994664 | 0.84 | NT5E (0.37) | NT5ESYKCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23993079 | 0.82 | NT5E (0.42) | NT5EKMT2AMEN1ALDH1A1 | |
| SCHEMBL23994321 | 0.82 | MEN1 (0.54) | NT5EKMT2AMEN1SYKCYP1A2 | |
| SCHEMBL23994331 | 0.81 | SYK (0.35) | NT5ESYKCYP1A2CYP3A4CYP2D6 |
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-2021222522-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2021-11-04 | — | — | WO | disclosed |