Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | PDE1A | P54750 | 1/20 | 0.34 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 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 | |
|---|---|---|---|---|
| SCHEMBL19906097 | 0.90 | KDM4E (0.41) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19906064 | 0.90 | KDM4E (0.41) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19906086 | 0.86 | KDM4E (0.39) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19905882 | 0.85 | KDM4E (0.41) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19905884 | 0.85 | KDM4E (0.38) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19906325 | 0.84 | CNR1 (0.44) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19906139 | 0.84 | PTGDR2 (0.43) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19905854 | 0.84 | MET (0.39) | KDM4ENPC1RAB9A | |
| SCHEMBL19905876 | 0.84 | PTGDR2 (0.42) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL19905803 | 0.84 | KDM4E (0.39) | KDM4EPTGDR2ALDH1A1CYP1A2CYP2C9 |
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 |