Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 1/20 | 0.56 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.53 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | TET3 | O43151 | 1/20 | 0.47 |
| ▸ | FBXL19 | Q6PCT2 | 1/20 | 0.47 |
| ▸ | CXXC5 | Q7LFL8 | 1/20 | 0.47 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.47 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.47 |
| ▸ | CXXC4 | Q9H2H0 | 1/20 | 0.47 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 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 | |
|---|---|---|---|---|
| SCHEMBL2722547 | 0.86 | AKR1C1 (0.57) | OPRL1HSD11B1AKR1C1MLYCDKMT2A | |
| SCHEMBL501923 | 0.86 | AKR1C1 (0.57) | OPRL1HSD11B1AKR1C1MLYCDKMT2A | |
| SCHEMBL8365912 | 0.86 | HSD11B1 (0.58) | OPRL1HSD11B1AKR1C1MLYCDKMT2A | |
| SCHEMBL12227090 | 0.86 | OPRM1 (0.61) | OPRL1HSD11B1MLYCDADRA1AADRA1D | |
| Hydrochloric Acid SCHEMBL1804765 | 0.84 | AKR1C1 (0.55) | OPRL1HSD11B1AKR1C1MLYCDKMT2A | |
| SCHEMBL7975314 | 0.83 | HSD11B1 (0.55) | OPRL1HSD11B1KMT2ATET3FBXL19 | |
| SCHEMBL2701832 | 0.83 | KMT2A (0.57) | OPRL1HSD11B1AKR1C1MLYCDKMT2A | |
| SCHEMBL42114 | 0.82 | AKR1C1 (0.70) | OPRL1HSD11B1AKR1C1KMT2AMEN1 | |
| SCHEMBL2184245 | 0.82 | AKR1C1 (0.64) | OPRL1HSD11B1AKR1C1KMT2AMEN1 | |
| SCHEMBL17520399 | 0.82 | OPRM1 (0.69) | OPRL1KMT2AMEN1ADRA1AADRA1D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810991-B1 | 1-ARYL-2-ACYLAMINO-ETHANE COMPOUNDS AND THEIR USE AS NEUROKININ ESPECIALLY NEUROKININ 1 ANTAGONISTS | NOVARTIS AG (CH) | 1999-04-14 | — | — | EP | disclosed |
| EP-0810991-A1 | 1-ARYL-2-ACYLAMINO-ETHANE COMPOUNDS AND THEIR USE AS NEUROKININ ESPECIALLY NEUROKININ 1 ANTAGONISTS | Novartis AG (CH) | 1997-12-10 | — | — | EP | disclosed |
| WO-1996026183-A1 | 1-ARYL-2-ACYLAMINO-ETHANE COMPOUNDS AND THEIR USE AS NEUROKININ ESPECIALLY NEUROKININ 1 ANTAGONISTS | NOVARTIS AG (CH) | 1996-08-29 | — | — | WO | disclosed |