Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.58 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.58 |
| ▸ | GAK | O14976 | 2/20 | 0.57 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.57 |
| ▸ | COQ8A | Q8NI60 | 1/20 | 0.57 |
| ▸ | NLK | Q9UBE8 | 1/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.53 |
| ▸ | PTK6 | Q13882 | 3/20 | 0.53 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.51 |
| ▸ | MITF | O75030 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL19633573 | 0.90 | KMT2A (0.49) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633684 | 0.89 | KMT2A (0.64) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633806 | 0.88 | KMT2A (0.51) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633549 | 0.87 | KMT2A (0.55) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633777 | 0.86 | GAK (0.57) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633569 | 0.85 | KMT2A (0.52) | AKR1C3AKR1C2ABCG2PTK6PDGFRA | |
| SCHEMBL19633676 | 0.84 | GAK (0.68) | GAKRIPK2COQ8ANLKABCG2 | |
| SCHEMBL9069952 | 0.84 | GAK (0.63) | AKR1C3AKR1C2GAKRIPK2COQ8A | |
| SCHEMBL19633574 | 0.84 | CTSV (0.56) | ABCG2PTK6MITFLMNAKMT2A | |
| SCHEMBL19633621 | 0.84 | KMT2A (0.49) | AKR1C3AKR1C2ABCG2PTK6PDGFRA |
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-2017198196-A1 | QUINOLINE DERIVATIVE HAVING ANTI-TUMOR ACTIVITY | 王子厚 | 2017-11-23 | — | — | WO | disclosed |