Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28188463 | 0.81 | ALDH1A1 (0.49) | L3MBTL1KMT2AALDH1A1MEN1SMN1; SMN2 | |
| SCHEMBL2098556 | 0.77 | PTGIR (0.42) | TDP1ATML3MBTL1KMT2AMEN1 | |
| SCHEMBL15650010 | 0.76 | MAPK1 (0.48) | KMT2AALDH1A1MEN1SMN1; SMN2CYP2C9 | |
| SCHEMBL5559017 | 0.72 | MEN1 (0.39) | TDP1ATML3MBTL1KMT2AALDH1A1 | |
| SCHEMBL1013201 | 0.72 | TDP1 (0.37) | TDP1ATML3MBTL1KMT2AALDH1A1 | |
| SCHEMBL1008397 | 0.72 | NPSR1 (0.44) | TDP1ATML3MBTL1KMT2AALDH1A1 | |
| SCHEMBL9335045 | 0.71 | HTT (0.46) | CHRNB2CHRNB4CHRNA3CHRNA4TDP1 | |
| SCHEMBL2094472 | 0.71 | PTGIR (0.53) | CHRNB2CHRNB4CHRNA3CHRNA4TDP1 | |
| SCHEMBL3938034 | 0.70 | NPSR1 (0.43) | TDP1ATML3MBTL1KMT2AALDH1A1 | |
| SCHEMBL27492068 | 0.70 | CHRNB2 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4TDP1 |
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 |