Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL22702081 | 0.83 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2POLBMAOAMAOB | |
| SCHEMBL22702133 | 0.76 | ADH1B (0.46) | ALDH1A1SMN1; SMN2POLBMAPTMAOA | |
| SCHEMBL15066769 | 0.74 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2POLBMAOAMAOB | |
| SCHEMBL6866606 | 0.73 | MAOA (0.57) | ALDH1A1SMN1; SMN2POLBMAOAMAOB | |
| SCHEMBL6866612 | 0.73 | MAOA (0.57) | ALDH1A1SMN1; SMN2POLBMAOAMAOB | |
| SCHEMBL22307241 | 0.72 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2POLBMAOAMAOB | |
| SCHEMBL4782825 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2CYP1A2POLBCYP2D6 | |
| SCHEMBL13373201 | 0.70 | MAOA (0.50) | ALDH1A1SMN1; SMN2CYP1A2MAPTMAOA | |
| SCHEMBL12069840 | 0.70 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CYP1A2POLBCYP2D6 | |
| SCHEMBL12046092 | 0.70 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2CYP1A2POLBCYP2D6 |
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-3319955-B1 | 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS | GILEAD SCIENCES INC (US) | 2020-11-25 | — | — | EP | disclosed |