Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | PDE1A | P54750 | 1/20 | 0.35 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.35 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | MAT2A | P31153 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | POLQ | O75417 | 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 | |
|---|---|---|---|---|
| SCHEMBL19906163 | 0.93 | KDM4E (0.36) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906178 | 0.93 | PTGDR2 (0.35) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906166 | 0.86 | KDM4E (0.40) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906010 | 0.85 | KDM4E (0.36) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906327 | 0.85 | PTGDR2 (0.38) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906377 | 0.84 | PTGDR2 (0.39) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906170 | 0.83 | KDM4E (0.41) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19905848 | 0.81 | KDM4E (0.36) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL15342577 | 0.81 | CYP3A4 (0.39) | MAT2A | |
| SCHEMBL19906287 | 0.81 | KDR (0.37) | KDM4EPTGDR2ALDH1A1MEN1KMT2A |
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-3070081-B1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | GILEAD SCIENCES INC (US) | 2018-02-28 | — | — | EP | disclosed |