Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH4 | P08319 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | PRKCB | P05771 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
| ▸ | PRKCH | P24723 | 1/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | PRKCE | Q02156 | 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 | |
|---|---|---|---|---|
| SCHEMBL2490684 | 1.00 | ACE2 (0.45) | ACE2OPRM1SPHK1LMNADNM1 | |
| SCHEMBL28299272 | 1.00 | ACE2 (0.45) | ACE2OPRM1SPHK1LMNADNM1 | |
| SCHEMBL7067186 | 0.98 | OPRM1 (0.44) | ACE2OPRM1SPHK1LMNADNM1 | |
| Hexane SCHEMBL27310611 | 0.93 | DNM1 (0.40) | ACE2OPRM1SPHK1DNM1TSHR | |
| Octane SCHEMBL22230525 | 0.91 | TSHR (0.39) | ACE2OPRM1SPHK1LMNADNM1 | |
| SCHEMBL18681323 | 0.90 | DNM1 (0.36) | ACE2OPRM1LMNADNM1TSHR | |
| SCHEMBL527036 | 0.88 | LMNA (0.44) | ACE2OPRM1SPHK1LMNADNM1 | |
| Octane SCHEMBL28602966 | 0.83 | TSHR (0.40) | ACE2OPRM1DNM1TSHRTHRB | |
| SCHEMBL9403621 | 0.83 | LMNA (0.55) | LMNA | |
| SCHEMBL19956854 | 0.82 | OPRM1 (0.44) | ACE2OPRM1SPHK1LMNADNM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2448907-A2 | NOVEL ESTERS, AND USE THEREOF | Cognis IP Management GmbH (DE) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011000489-A2 | NOVEL ESTERS, AND USE THEREOF | COGNIS IP MANAGEMENT GMBH (DE) | 2011-01-06 | — | — | WO | disclosed |