Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.67 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.63 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.63 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.63 |
| ▸ | CES2 | O00748 | 1/20 | 0.61 |
| ▸ | CES1 | P23141 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | KMO | O15229 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8629297 | 1.00 | TSHR (0.67) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL8629294 | 1.00 | TSHR (0.67) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL894417 | 0.80 | TSHR (1.00) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL29848105 | 0.80 | TSHR (1.00) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL8626889 | 0.80 | MAPT (0.49) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL5067640 | 0.80 | MAPT (0.49) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL5067634 | 0.80 | MAPT (0.49) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL27337195 | 0.79 | ALDH1A1 (0.61) | TSHRPRSS1PRSS2PRSS3CES2 | |
| Hydrochloric Acid SCHEMBL7389430 | 0.79 | TSHR (0.96) | TSHRPRSS1PRSS2PRSS3CES2 | |
| SCHEMBL2308208 | 0.79 | TSHR (0.71) | TSHRPRSS1PRSS2PRSS3CES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0672646-B1 | Process for producing beta-nitro-enamines and intermediates thereof | SUMITOMO CHEMICAL CO (JP) | 1998-06-10 | — | — | EP | disclosed |
| US-5639895-A | Process for producing β-nitroenamine | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-06-17 | — | — | US | disclosed |
| US-5597940-A | REACTING NITROOLEFIN WITH HYDROXYLAMINE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-01-28 | — | — | US | disclosed |
| EP-0672646-A1 | Process for producing beta-nitro-enamines and intermediates thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-09-20 | — | — | EP | disclosed |