Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL10284225 | 0.81 | KDM4E (0.44) | KDM4EALDH1A1PTGDR2PTGS2MAPT | |
| SCHEMBL20021131 | 0.81 | PTGDR2 (0.47) | KDM4EALDH1A1PTGDR2PTGS2MAPT | |
| SCHEMBL3315614 | 0.80 | CYP3A4 (0.41) | CNR2KDM4EALDH1A1CNR1MDM4 | |
| SCHEMBL15182598 | 0.78 | ALDH1A1 (0.37) | CNR2KDM4EALDH1A1CNR1MDM4 | |
| SCHEMBL3326729 | 0.76 | ACHE (0.47) | KDM4EALDH1A1MAPTHSD17B10KMT2A | |
| SCHEMBL3303958 | 0.74 | KMT2A (0.49) | KDM4EALDH1A1PTGDR2HSD17B10GAA | |
| SCHEMBL3346070 | 0.69 | KDM4E (0.43) | KDM4EALDH1A1PTGDR2PTGS2MAPT | |
| SCHEMBL20021094 | 0.69 | MEN1 (0.46) | KDM4EALDH1A1PTGDR2MAPTGAA | |
| SCHEMBL20021162 | 0.69 | KDM4E (0.43) | KDM4EALDH1A1PTGDR2PTGS2MAPT | |
| SCHEMBL20021151 | 0.67 | MEN1 (0.44) | KDM4EALDH1A1PTGDR2GAAKMT2A |
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 |