Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7748881 | 0.85 | ZDHHC7 (0.49) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL1415328 | 0.83 | ZDHHC7 (0.55) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL2719658 | 0.83 | ALDH1A1 (0.52) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL1415321 | 0.83 | ALDH1A1 (0.52) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL11359475 | 0.82 | ZDHHC7 (0.53) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL11189012 | 0.82 | ALDH1A1 (0.50) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL8056492 | 0.82 | ZDHHC7 (0.58) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL14840774 | 0.82 | ALDH1A1 (0.50) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL1415492 | 0.82 | ZDHHC7 (0.63) | ALDH1A1ATMZDHHC7TSHRHPGD | |
| SCHEMBL1415620 | 0.82 | ZDHHC7 (0.58) | ALDH1A1ATMZDHHC7TSHRHPGD |
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-2004039772-A1 | PROCESS FOR PREPARING S-(2-AMINOETHYL)-2-METHYL-L-CYSTEINE | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-05-13 | — | — | WO | disclosed |