Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL28008005 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL19543206 | 0.80 | RAB9A (0.58) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL7108824 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL21616473 | 0.78 | RAB9A (0.53) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL29911025 | 0.78 | ALDH1A1 (0.60) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL57736 | 0.78 | ALDH1A1 (0.60) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL32690775 | 0.77 | ALDH1A1 (0.49) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL8356047 | 0.77 | CYP1A2 (0.49) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL9178803 | 0.77 | ALDH1A1 (0.56) | ALDH1A1HTTKMT2ATDP1L3MBTL1 | |
| SCHEMBL25863 | 0.76 | HTR2A (0.53) | ALDH1A1KMT2ARAB9ANPC1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004052841-A1 | CARBIDOPA PRODRUGS AND USES THEREOF | XENOPORT, INC. (US) | 2004-06-24 | — | — | WO | disclosed |
| EP-1284960-A1 | CYCLIC AMINO ACID DERIVATIVES USEFUL AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2003-02-26 | — | — | EP | disclosed |
| WO-2001090052-A1 | CYCLIC AMINO ACID DERIVATIVES USEFUL AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2001-11-29 | — | — | WO | disclosed |