Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ENPEP | Q07075 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GABRP | O00591 | 3/20 | 0.38 |
| ▸ | GABRD | O14764 | 3/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8531394 | 0.88 | CYP2D6 (0.61) | NFKB1TSHRCYP2D6BLMKMT2A | |
| SCHEMBL10915178 | 0.88 | CYP2D6 (0.61) | NFKB1TSHRCYP2D6BLMKMT2A | |
| SCHEMBL8531395 | 0.88 | CYP2D6 (0.61) | NFKB1TSHRCYP2D6BLMKMT2A | |
| Hydrochloric Acid SCHEMBL10963195 | 0.86 | CYP2D6 (0.59) | NFKB1TSHRCYP2D6BLMKMT2A | |
| Hydrochloric Acid SCHEMBL10963203 | 0.86 | CYP2D6 (0.59) | NFKB1TSHRCYP2D6BLMKMT2A | |
| Hydrochloric Acid SCHEMBL10963186 | 0.86 | CYP2D6 (0.59) | NFKB1TSHRCYP2D6BLMKMT2A | |
| SCHEMBL28664295 | 0.77 | NFKB1 (0.38) | NFKB1TSHRCYP2D6BLMKMT2A | |
| SCHEMBL12019170 | 0.75 | ENPEP (0.52) | NFKB1TSHRCYP2D6BLMKMT2A | |
| Bicarbonate SCHEMBL8532146 | 0.74 | GRIK1 (0.37) | NFKB1TSHRCYP2D6BLMKMT2A | |
| SCHEMBL9635488 | 0.74 | GSR (0.43) | BLMKMT2AALDH1A1CYP1A2GRM8 |
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-0705240-B1 | NOVEL PROCESSES FOR PREPARING (S)-4-AMINO-HEPTA-5,6-DIENOIC ACID AND INTERMEDIATES THEREOF | MERRELL PHARMA INC (US) | 1998-01-07 | — | — | EP | claimed |