Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | PPARA | Q07869 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23130315 | 0.84 | CYP2D6 (0.35) | CYP2D6SRCLMNAMAPK1TSHR | |
| SCHEMBL23130218 | 0.83 | PPARG (0.30) | PPARAPPARG | |
| SCHEMBL710572 | 0.82 | CYP2D6 (0.46) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL14617697 | 0.79 | MMP8 (0.49) | LMNATSHRALDH1A1GAAPKM | |
| SCHEMBL155984 | 0.77 | ALDH1A1 (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL104518 | 0.77 | ALDH1A1 (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL103235 | 0.77 | ALDH1A1 (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL8400939 | 0.76 | SRC (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL1305806 | 0.76 | TSHR (0.38) | LMNATSHRALDH1A1CYP3A4AKR1C3 | |
| Hydrochloric Acid SCHEMBL6178991 | 0.75 | ALDH1A1 (0.53) | CYP2D6SRCLMNAMAPK1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4093801-A | BACTERICIDES | E. R. SQUIBB & SONS, INC. (US) | 1978-06-06 | — | — | US | disclosed |
| US-4063019-A | BACTERICIDE | E. R. SQUIBB & SONS, INC. (US) | 1977-12-13 | — | — | US | disclosed |