Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6822290 | 0.87 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2POLBTSHR | |
| SCHEMBL23583803 | 0.74 | CHRM2 (0.37) | KMT2AMEN1NR1H2ELANE | |
| SCHEMBL29589805 | 0.69 | GBA2 (0.39) | ALDH1A1LMNASMN1; SMN2POLBBCHE | |
| SCHEMBL11528226 | 0.69 | TSHR (0.51) | ALDH1A1LMNASMN1; SMN2TSHRTDP1 | |
| SCHEMBL30890751 | 0.68 | ALDH1A1 (0.42) | ALDH1A1LMNASMN1; SMN2POLBBCHE | |
| SCHEMBL9826100 | 0.67 | NAAA (0.42) | ALDH1A1LMNASMN1; SMN2POLBBCHE | |
| SCHEMBL14834677 | 0.67 | ATM (0.37) | ALDH1A1LMNASMN1; SMN2POLBBCHE | |
| SCHEMBL31296901 | 0.66 | TSHR (0.51) | ALDH1A1LMNASMN1; SMN2TSHRTDP1 | |
| SCHEMBL11527713 | 0.65 | TSHR (0.53) | ALDH1A1LMNAPOLBTSHRTDP1 | |
| SCHEMBL5963244 | 0.65 | BCHE (0.44) | ALDH1A1LMNASMN1; SMN2POLBBCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1003903-B1 | PROCESS FOR PREPARING ENANTIOMERICALLY ENRICHED N-DERIVATISED LACTAMS | GLAXO GROUP LTD (GB) | 2003-02-26 | — | — | EP | disclosed |
| US-6340587-B1 | TREATING RACEMIC MIXTURE WITH ACYLASE; ISOLATING PURE ENANTIOMORPH OF N-PROTECTED (1R,4S)-2-AZABICYCLO(2.2.1)HEPT-5-EN-3-ONE | SMITHKLINE BEECHAM CORPORATION | 2002-01-22 | — | — | US | disclosed |