Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL2945602 | 0.87 | ALDH1A1 (0.48) | CYP1A2ALDH1A1HTR2APTGS2 | |
| SCHEMBL10729669 | 0.82 | CYP1A2 (0.41) | CYP3A4HPGDCYP1A2ALDH1A1FFAR4 | |
| SCHEMBL9513058 | 0.82 | CYP1A2 (0.41) | CYP3A4HPGDCYP1A2ALDH1A1FFAR4 | |
| SCHEMBL10734341 | 0.82 | MAPT (0.46) | CYP3A4HPGDCYP1A2ALDH1A1PTPN1 | |
| SCHEMBL12925519 | 0.81 | CYP3A4 (0.43) | CYP3A4HPGDCYP1A2ALDH1A1HTR2A | |
| SCHEMBL13310100 | 0.81 | DHFR (0.44) | DHFRALDH1A1PTGS2 | |
| SCHEMBL2955343 | 0.79 | ALDH1A1 (0.56) | CYP3A4HPGDCYP1A2ALDH1A1FFAR4 | |
| SCHEMBL10044958 | 0.79 | CYP1A2 (0.65) | CYP3A4CYP1A2ALDH1A1HTR2APTGS2 | |
| SCHEMBL10477447 | 0.78 | CYP3A4 (0.41) | CYP3A4HPGDCYP1A2ALDH1A1FFAR4 | |
| SCHEMBL16546632 | 0.78 | CYP3A4 (0.49) | CYP3A4HPGDALDH1A1FFAR4PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012052420-A1 | METHOD FOR PREPARING SUBSTITUTED N-(3-AMINO-QUINOXALIN-2-YL)-SULFONAMIDES AND THEIR INTERMEDIATES N-(3-CHLORO-QUINOXALIN-2-YL)SULFONAMIDES | MERCK SERONO S.A. GENEVA (CH) | 2012-04-26 | — | — | WO | disclosed |
| US-20100285407-A1 | Composition for forming a silicon-containing antireflection film, substrate having the silicon-containing antireflection film from the composition and patterning process using the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2010-11-11 | — | — | US | disclosed |