Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL10365922 | 0.99 | CES2 (0.37) | CES2CES1ALDH1A1L3MBTL1PTPN1 | |
| Bromide SCHEMBL8305746 | 0.99 | CES2 (0.37) | CES2CES1ALDH1A1L3MBTL1PTPN1 | |
| Bromide SCHEMBL8305743 | 0.99 | CES2 (0.37) | CES2CES1ALDH1A1L3MBTL1PTPN1 | |
| SCHEMBL10365425 | 0.86 | ALDH1A1 (0.39) | CES2CES1ALDH1A1PTPN1ERCC5 | |
| SCHEMBL10365541 | 0.86 | CES2 (0.38) | CES2CES1ALDH1A1PTPN1ERCC5 | |
| SCHEMBL8309075 | 0.84 | GAA (0.41) | CES2CES1ALDH1A1PTPN1ERCC5 | |
| SCHEMBL8441148 | 0.84 | GABRP (0.48) | CES2CES1ALDH1A1ERCC5FEN1 | |
| SCHEMBL8308215 | 0.83 | LMNA (0.41) | GAAKAT6ARAB9A | |
| Bromide SCHEMBL10365170 | 0.83 | GAA (0.40) | CES2CES1ALDH1A1PTPN1ERCC5 | |
| SCHEMBL10365264 | 0.83 | CES2 (0.42) | CES2CES1ALDH1A1PTPN1ERCC5 |
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-0582182-B1 | 1-Aminoacetamidopyrroles and 1-amino-2-(substituted) pyrroles and their use for the treatment of neurodegenerative dysfunctions | HOECHST MARION ROUSSEL INC (US) | 1999-10-20 | — | — | EP | claimed |
| US-4588727-A | ANALGESICS, TRANQUILLIZERS, ANTICONVULSANTS | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1986-05-13 | — | — | US | claimed |