Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7154189 | 0.88 | MEN1 (0.65) | ALDH1A1HPGDHTTLMNATSHR | |
| SCHEMBL10156660 | 0.87 | HPGD (0.67) | ALDH1A1HPGDPOLBHTTLMNA | |
| SCHEMBL7503096 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HPGDHTTLMNATSHR | |
| SCHEMBL18753369 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HPGDHTTLMNATSHR | |
| SCHEMBL22172135 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HPGDPOLBHTTLMNA | |
| SCHEMBL15651032 | 0.84 | ALDH1A1 (0.60) | ALDH1A1HPGDPOLBLMNATSHR | |
| SCHEMBL18754001 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTLMNATSHR | |
| SCHEMBL7871104 | 0.84 | HPGD (0.63) | ALDH1A1HPGDPOLBHTTLMNA | |
| SCHEMBL1447972 | 0.84 | ALDH1A1 (0.63) | ALDH1A1HPGDPOLBHTTLMNA | |
| SCHEMBL3925726 | 0.84 | HTT (0.55) | ALDH1A1HPGDPOLBHTTLMNA |
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-3241554-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2020-01-29 | — | — | EP | disclosed |