Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.40 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 4/20 | 0.39 |
| ▸ | ACACA | Q13085 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12476530 | 0.85 | ACACB (0.49) | ACACBACACAKMT2AMAPTMEN1 | |
| SCHEMBL17050446 | 0.84 | NQO1 (0.47) | TP53CYP3A4ACACBACACAKMT2A | |
| SCHEMBL12476020 | 0.82 | LYN (0.44) | ACACBACACAKMT2AMEN1ALDH1A1 | |
| SCHEMBL5943008 | 0.79 | ICAM1 (0.51) | KMT2AMAPTMEN1 | |
| SCHEMBL12476562 | 0.79 | ACACB (0.42) | MAPK1TP53CYP3A4ACACBKMT2A | |
| SCHEMBL12476222 | 0.78 | ACACB (0.50) | TP53CYP3A4ACACBMAPTUSP2 | |
| SCHEMBL12475966 | 0.78 | ACACB (0.45) | TP53CYP3A4ACACBACACAKMT2A | |
| SCHEMBL12475977 | 0.77 | MLYCD (0.51) | ACACBACACAMAPTALDH1A1LTA4H | |
| SCHEMBL1367197 | 0.75 | — | — | |
| SCHEMBL9488001 | 0.75 | TP53 (0.63) | MAPK1TP53CYP3A4ACACBACACA |
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-2012090219-A2 | THIAZOLE COMPOUNDS USEFUL AS ACETYL-COA CARBOXYLASE (ACC) INHIBITORS | JUBILANT BIOSYS LTD. (IN) | 2012-07-05 | — | — | WO | disclosed |