Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NEDD4 | P46934 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11264388 | 0.80 | CYP1A2 (0.39) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL11264392 | 0.80 | CYP1A2 (0.39) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL11268644 | 0.78 | RXFP1 (0.42) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL11268763 | 0.77 | KDM4E (0.43) | ALDH1A1SMN1; SMN2MAPTHTTLMNA | |
| SCHEMBL11582440 | 0.72 | PKM (0.41) | ALDH1A1SMN1; SMN2MAPTLMNAKDM4E | |
| SCHEMBL11260068 | 0.69 | RXFP1 (0.45) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL27575155 | 0.67 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL17141916 | 0.67 | NEDD4 (0.72) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL11262261 | 0.66 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT | |
| SCHEMBL11252283 | 0.66 | KDM4E (0.42) | ALDH1A1SMN1; SMN2MAPTMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4349674-A | Quinoalinyl esters of carbamimidothioic acids | AMERICAN HOME PRODUCTS CORPORATION (US) | 1982-09-14 | — | — | US | disclosed |