Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 10/20 | 0.52 |
| ▸ | CNR2 | P34972 | 2/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | CASP2 | P42575 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.39 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28871096 | 0.93 | EPHX1 (0.46) | EPHX1CNR2CNR1CA12CA14 | |
| SCHEMBL11300837 | 0.90 | EPHX1 (0.47) | EPHX1CNR2CNR1ALDH1A1TSHR | |
| SCHEMBL15847268 | 0.89 | EPHX1 (0.50) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL11046643 | 0.87 | EPHX1 (0.54) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL3258368 | 0.87 | EPHX1 (0.54) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL28331554 | 0.87 | EPHX1 (0.54) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL11839026 | 0.87 | CNR2 (0.54) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL22556292 | 0.87 | CNR2 (0.58) | EPHX1CNR2CNR1NAAACASP2 | |
| Hydrochloric Acid SCHEMBL4439524 | 0.87 | EPHX1 (0.48) | EPHX1CNR2CNR1NAAACASP2 | |
| SCHEMBL28329403 | 0.87 | EPHX1 (0.54) | EPHX1CNR2CNR1NAAACASP2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4073795-A | Synthesis of tryptophans | HOFFMANN-LA ROCHE INC. (US) | 1978-02-14 | — | — | US | claimed |
| US-4316847-A | ARTIFICIAL SWEETENING | HOFFMANN-LA ROCHE INC. (US) | 1982-02-23 | — | — | US | disclosed |
| US-4256641-A | ALKYL ALPHA-CARBOXAMIDOINDOLE-3-ACRYLATES MADE FROM 3-INDOLECARBOXALDEHYDES AND MONOALKYL CARBOXAMIDOMALONATES | HOFFMANN-LA ROCHE INC. (US) | 1981-03-17 | — | — | US | disclosed |
| US-4140697-A | ARTIFICIAL SWEETENER | HOFFMANN-LA ROCHE INC. (US) | 1979-02-20 | — | — | US | disclosed |
| US-4073795-A | Synthesis of tryptophans | HOFFMANN-LA ROCHE INC. (US) | 1978-02-14 | — | — | US | disclosed |