Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CLK1 | P49759 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | YES1 | P07947 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIPK1 | Q86Z02 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL790646 | 0.92 | KDR (0.47) | KDRRAB9AALDH1A1F10LMNA | |
| SCHEMBL791145 | 0.88 | KDR (0.46) | KDRRAB9ACLK1DYRK1ALMNA | |
| SCHEMBL789889 | 0.83 | RAB9A (0.48) | KDRRAB9ACLK1DYRK1AABL1 | |
| SCHEMBL790786 | 0.81 | ALDH1A1 (0.52) | DYRK1AALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL789915 | 0.80 | RAB9A (0.50) | KDRRAB9ALMNAMAPTMEN1 | |
| SCHEMBL790093 | 0.80 | SMN1; SMN2 (0.48) | KDRRAB9AALDH1A1LMNAMAPT | |
| SCHEMBL790416 | 0.79 | MRGPRX4 (0.50) | KDRRAB9ACLK1DYRK1AALDH1A1 | |
| SCHEMBL790392 | 0.79 | KDR (0.48) | KDRRAB9ALMNAMAPTMAPK1 | |
| SCHEMBL791199 | 0.77 | RAB9A (0.50) | KDRRAB9ACLK1DYRK1ALMNA | |
| SCHEMBL807273 | 0.71 | ALDH1A1 (0.53) | RAB9AALDH1A1HPGDHSD17B10NPC1 |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |