Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.54 |
| ▸ | PDE5A | O76074 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 4/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | UBE2N | P61088 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL29316587 | 0.87 | TMIGD3 (0.54) | APPPDE5AKMT2A | |
| SCHEMBL7939004 | 0.77 | APP (0.68) | APPPDE5ACDK1ESR1PDE10A | |
| SCHEMBL18304005 | 0.75 | PDE5A (0.50) | APPPDE5ACDK1ESR1PDE4A | |
| SCHEMBL7011138 | 0.71 | APP (0.56) | APPPDE5ACDK1ESR1PDE10A | |
| SCHEMBL27248399 | 0.71 | PDE4A (0.62) | APPPDE5ACDK1ESR1EGFR | |
| SCHEMBL20164596 | 0.71 | APP (0.56) | APPPDE5ACDK1ESR1PDE4A | |
| SCHEMBL17443001 | 0.71 | CDK1 (0.53) | APPPDE5ACDK1ESR1PDE10A | |
| SCHEMBL21567259 | 0.70 | APP (0.67) | APPPDE5ACDK1ESR1EGFR | |
| SCHEMBL3444342 | 0.70 | APP (0.55) | APPPDE5ACDK1ESR1RAD52 | |
| SCHEMBL1216376 | 0.70 | CDK1 (0.55) | APPPDE5ACDK1ESR1PDE4A |
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-2018119284-A1 | ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF | CALITHERA BIOSCIENCES, INC. (US) | 2018-06-28 | — | — | WO | disclosed |