Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.37 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14830296 | 0.82 | HDAC4 (0.39) | HDAC3HDAC4HDAC1HDAC6GSK3B | |
| SCHEMBL14838653 | 0.79 | HSD17B2 (0.35) | HDAC3HDAC4HDAC1HDAC6GSK3B | |
| SCHEMBL14838652 | 0.74 | OXTR (0.41) | HDAC3HDAC4HDAC1HDAC6DAO | |
| SCHEMBL4695439 | 0.69 | HDAC3 (0.49) | HDAC3HDAC1ALDH1A1 | |
| SCHEMBL7027656 | 0.69 | LPAR1 (0.51) | LPAR1LPAR5ALDH1A1TSHRTDP1 | |
| SCHEMBL23512823 | 0.68 | POLB (0.49) | ALDH1A1POLBTSHROPRM1 | |
| SCHEMBL1336862 | 0.68 | POLB (0.49) | ALDH1A1POLBTSHROPRM1 | |
| SCHEMBL18970299 | 0.68 | POLB (0.49) | ALDH1A1POLBTSHROPRM1 | |
| SCHEMBL1336860 | 0.68 | POLB (0.49) | ALDH1A1POLBTSHROPRM1 | |
| SCHEMBL2203292 | 0.68 | HDAC6 (0.75) | HDAC3HDAC4HDAC1HDAC6TSHR |
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-2013046211-A1 | PROCESSES FOR THE PREPARATION OF 5-CHLORO-N-({(5S)-2-OXO-3-[4-(3-OXO-4-MORPHOLINYL) PHENYL]-1,3-OXAZOLIDIN-5-YL}METHYL)-2-THIOPHENE-CARBOXAMIDE AND INTERMEDIATES THEREOF | SYMED LABS LIMITED (IN) | 2013-04-04 | — | — | WO | disclosed |