Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | LAP3 | P28838 | 1/20 | 0.46 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.45 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27881559 | 1.00 | CYP1A2 (0.53) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL23947614 | 0.86 | ALDH1A1 (0.52) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL28148319 | 0.85 | ALDH1A1 (0.66) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL7782947 | 0.85 | ALDH1A1 (0.50) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL7419155 | 0.85 | SLC1A1 (0.60) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL14514418 | 0.85 | ALDH1A1 (0.50) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL7419152 | 0.85 | SLC1A1 (0.60) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL7782945 | 0.85 | ALDH1A1 (0.50) | CYP1A2CYP2D6PKMALDH1A1IDO1 | |
| SCHEMBL27670554 | 0.84 | LMNA (0.53) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Hydrochloric Acid SCHEMBL4704977 | 0.83 | ALDH1A1 (0.53) | CYP1A2CYP2D6PKMSMN1; SMN2ALDH1A1 |
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-1993024507-A1 | CONFORMATIONALLY RESTRAINED OLIGOMERS CONTAINING AMIDE OR CARBAMATE LINKAGES FOR SEQUENCE-SPECIFIC BINDING | GILEAD SCIENCES, INC. (US) | 1993-12-09 | — | — | WO | disclosed |