Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA12 | O43570 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA7 | P43166 | 4/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 4/20 | 0.46 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7194392 | 0.84 | KEAP1 (0.57) | KEAP1NFE2L2TDP1ALDH1A1ALOX12 | |
| SCHEMBL1911882 | 0.81 | TSHR (0.58) | KEAP1NFE2L2CA2CA1CA9 | |
| SCHEMBL6097634 | 0.79 | KEAP1 (0.53) | KEAP1NFE2L2TDP1ALDH1A1ALOX12 | |
| SCHEMBL28358893 | 0.78 | KMT2A (0.51) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL9813781 | 0.77 | ALDH1A1 (0.50) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL14495116 | 0.77 | KEAP1 (0.51) | KEAP1NFE2L2TDP1ALDH1A1ALOX12 | |
| SCHEMBL5763362 | 0.77 | KEAP1 (0.51) | KEAP1NFE2L2CA2ALDH1A1ALOX12 | |
| SCHEMBL10514057 | 0.76 | APEX1 (0.64) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL9813869 | 0.76 | ALDH1A1 (0.51) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL4250262 | 0.76 | PLCG1 (0.56) | KEAP1NFE2L2TDP1ALDH1A1ALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| US-6727294-B2 | RADIATION TRANSPARENT MOLDING MATERIALS | MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) | 2004-04-27 | — | — | US | disclosed |
| CN-1130358-C | Imidazole compound and preparation method and application thereof | SMITHKLINE BEECHAM CORP (US) | 2003-12-10 | — | — | CN | disclosed |
| US-20010034419-A1 | Radiation transparent molding materials | MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) | 2001-10-25 | — | — | US | disclosed |