Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3346070 | 0.82 | KDM4E (0.43) | KDM4EPTGDR2PTGS1PTGS2CYP2C19 | |
| SCHEMBL10284225 | 0.77 | KDM4E (0.44) | KDM4EPTGDR2PTGS1PTGS2CYP2C19 | |
| SCHEMBL244779 | 0.76 | CYP3A4 (0.45) | CYP3A4 | |
| SCHEMBL15182653 | 0.74 | CYP3A4 (0.37) | KDM4EALDH1A1CYP3A4 | |
| SCHEMBL3344083 | 0.73 | KDM4E (0.53) | KDM4EPTGDR2MEN1LMNAKMT2A | |
| SCHEMBL20021131 | 0.73 | PTGDR2 (0.47) | KDM4EPTGDR2PTGS1PTGS2CYP2C19 | |
| SCHEMBL3297610 | 0.72 | KDM4E (0.54) | KDM4EPTGDR2MEN1LMNAKMT2A | |
| SCHEMBL3303954 | 0.71 | KDM4E (0.53) | KDM4EPTGDR2MEN1LMNAMAPT | |
| SCHEMBL3314187 | 0.71 | KDM4E (0.50) | KDM4EPTGDR2PTGS1PTGS2CYP2C19 | |
| SCHEMBL20021122 | 0.70 | KDM4E (0.52) | KDM4EPTGDR2MEN1LMNAKMT2A |
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-2588455-B1 | 2-QUINOLINYL-ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES INC (US) | 2018-04-04 | — | — | EP | disclosed |