Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6832635 | 1.00 | CES2 (0.44) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL10433270 | 0.87 | TSHR (0.42) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL10433272 | 0.87 | TSHR (0.42) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL28789945 | 0.82 | CES2 (0.46) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL2184443 | 0.80 | ALDH1A1 (0.44) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL1174501 | 0.80 | ALDH1A1 (0.44) | CES2CES1PRMT1CA2CA4 | |
| SCHEMBL6206779 | 0.76 | CES2 (0.49) | CES2CES1PRMT1TSHRALDH1A1 | |
| SCHEMBL6206786 | 0.76 | CES2 (0.49) | CES2CES1PRMT1TSHRALDH1A1 | |
| SCHEMBL523842 | 0.75 | CES1 (0.58) | CES2CES1CA2CA4PTPN1 | |
| SCHEMBL114583 | 0.75 | CES1 (0.58) | CES2CES1CA2CA4PTPN1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2841422-A1 | METHODS FOR THE SYNTHESIS OF ETHYLFUMARATES AND THEIR USE AS INTERMEDIATES | Mannkind Corporation (US) | 2015-03-04 | — | — | EP | disclosed |
| WO-2013162764-A1 | METHODS FOR THE SYNTHESIS OF ETHYLFUMARATES AND THEIR USE AS INTERMEDIATES | MANNKIND CORP (US) | 2013-10-31 | — | — | WO | disclosed |
| EP-1456226-A1 | SITE SELECTIVE ACYLATION | ModPro AB (SE) | 2004-09-15 | — | — | EP | disclosed |
| WO-2003044042-A1 | SITE SELECTIVE ACYLATION | MODPRO AB (SE) | 2003-05-30 | — | — | WO | disclosed |
| EP-0952980-A1 | ACYL TRANSFER WITH STABILISED TRANSITION COMPLEX USING CATALYST WITH CATALYTIC IMIDAZOLE (E.G. HISTIDINE) FUNCTION | A+Science Invest AB (SE) | 1999-11-03 | — | — | EP | disclosed |
| WO-1997043302-A9 | ACYL TRANSFER WITH STABILISED TRANSITION COMPLEX USING CATALYST WITH CATALYTIC IMIDAZOLE (E.G. HISTIDINE) FUNCTION | — | 1998-12-23 | — | — | WO | disclosed |
| WO-1997043302-A1 | ACYL TRANSFER WITH STABILISED TRANSITION COMPLEX USING CATALYST WITH CATALYTIC IMIDAZOLE (E.G. HISTIDINE) FUNCTION | A+SCIENCE INVEST AB (SE) | 1997-11-20 | — | — | WO | disclosed |