Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | FGB | P02675 | 1/20 | 0.32 |
| ▸ | S100A4 | P26447 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | PLEC | Q15149 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL6965178 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL6969794 | 0.76 | ALDH1A1 (0.42) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| SCHEMBL8546560 | 0.76 | ALDH1A1 (0.42) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| SCHEMBL8593312 | 0.75 | ALDH1A1 (0.39) | ALDH1A1MAPTKMT2AMEN1CYP1A2 | |
| SCHEMBL8552649 | 0.74 | ALDH1A1 (0.40) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| (2-Nitrovinyl)Benzene SCHEMBL8549031 | 0.71 | FBP1 (0.40) | CA1ALDH1A1KMT2AMEN1MAPK1 | |
| SCHEMBL6974296 | 0.70 | TDP1 (0.43) | CA1ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL6972927 | 0.68 | SMN1; SMN2 (0.43) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| SCHEMBL3323932 | 0.67 | ALDH1A1 (0.50) | ALDH1A1MAPTKMT2AMEN1CYP1A2 | |
| SCHEMBL6680488 | 0.67 | ALDH1A1 (0.50) | ALDH1A1MAPTKMT2AMEN1CYP1A2 |
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-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | claimed |