Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27666279 | 0.98 | TSHR (0.54) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL7769158 | 0.98 | TSHR (0.54) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL2811884 | 0.95 | ESR1 (0.53) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL10974841 | 0.89 | ALDH1A1 (0.50) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL1609725 | 0.82 | CA12 (0.47) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL18154629 | 0.78 | TSHR (0.61) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL15422580 | 0.77 | ALDH1A1 (0.62) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL16267961 | 0.77 | ALDH1A1 (0.62) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL16268280 | 0.77 | ALDH1A1 (0.62) | TSHRMAPK1CYP3A4TP53ALDH1A1 | |
| SCHEMBL28708367 | 0.77 | ALDH1A1 (0.62) | TSHRMAPK1CYP3A4TP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100497345-C | 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis | OTSUKA PHARMA CO LTD (JP) | 2009-06-10 | — | — | CN | disclosed |
| CN-1878777-A | 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis | OTSUKA PHARMA CO LTD (JP) | 2006-12-13 | — | — | CN | disclosed |