Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | LCK | P06239 | 3/20 | 0.48 |
| ▸ | NQO2 | P16083 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL33527 | 0.86 | — | — | |
| SCHEMBL4862349 | 0.86 | ALOX5 (0.60) | PTGS2LCKNQO2ALOX5CES2 | |
| SCHEMBL29829218 | 0.86 | — | — | |
| Formaldehyde SCHEMBL732503 | 0.83 | ALOX5 (0.52) | PTGS2KDM4ERAB9ALCKNQO2 | |
| SCHEMBL31122728 | 0.83 | ALOX5 (0.57) | PTGS2LCKNQO2ALOX5CES2 | |
| SCHEMBL6676690 | 0.83 | ALOX5 (0.57) | PTGS2LCKNQO2ALOX5CES2 | |
| Hydrogen Sulfide SCHEMBL11691776 | 0.83 | ALOX5 (0.57) | PTGS2LCKNQO2ALOX5CES2 | |
| Water SCHEMBL27732048 | 0.83 | ALOX5 (0.57) | PTGS2LCKNQO2ALOX5CES2 | |
| Phosphine SCHEMBL11514630 | 0.83 | ALOX5 (0.57) | PTGS2LCKNQO2ALOX5CES2 | |
| Benzene SCHEMBL21834592 | 0.80 | ALOX5 (0.56) | PTGS2LCKNQO2ALOX5MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106536501-A | Nicotine salts, co-crystals and salt co-crystal complexes | R.J.雷诺兹烟草公司 | 2017-03-22 | — | — | CN | disclosed |
| CN-1292884-C | Selectively controlling in-mold coating flow including inlet flow control and removable containment flange | OMNOVA SOLUTIONS INC (US) | 2007-01-03 | — | — | CN | disclosed |
| CN-1649711-A | Selectively controlling in-mold coating flow including inlet flow control and removable containment flange | OMNOVA SOLUTIONS INC (US) | 2005-08-03 | — | — | CN | disclosed |
| CN-1642711-A | Mold runner for preventing in-mold covering layer from gushing | OMNOVA SOLUTIONS INC (US) | 2005-07-20 | — | — | CN | disclosed |