Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8788397 | 0.81 | NPSR1 (0.55) | GRM5KMT2AALDH1A1CYP3A4NPSR1 | |
| SCHEMBL9078674 | 0.72 | AOC3 (0.48) | KMT2AALDH1A1LMNANPSR1SMN1; SMN2 | |
| SCHEMBL9430611 | 0.71 | ABCG2 (0.45) | ALDH1A1KDM4ELMNANPSR1SMN1; SMN2 | |
| SCHEMBL24022853 | 0.70 | ACHE (0.48) | GRM5KMT2AACHEALDH1A1CYP3A4 | |
| SCHEMBL9180022 | 0.70 | TSHR (0.36) | GRM5KMT2AALDH1A1NPSR1SMN1; SMN2 | |
| SCHEMBL14951063 | 0.68 | ACHE (0.50) | GRM5KMT2AACHEALDH1A1CYP3A4 | |
| SCHEMBL21889509 | 0.68 | LTA4H (0.55) | ALDH1A1KDM4ELMNASMN1; SMN2USP2 | |
| SCHEMBL9257076 | 0.68 | ALDH1A1 (0.39) | KMT2AALDH1A1KDM4ELMNANPSR1 | |
| SCHEMBL9429885 | 0.65 | ABCG2 (0.40) | NPSR1SMN1; SMN2NPC1RAB9AL3MBTL1 | |
| SCHEMBL7015622 | 0.65 | PBRM1 (0.41) | ALDH1A1KDM4ELMNANPSR1SMN1; SMN2 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3112352-A1 | OPIOID RECEPTOR MODULATORS | Janssen Pharmaceutica NV (BE) | 2017-01-04 | — | — | EP | claimed |
| EP-1725537-B1 | NOVEL COMPOUNDS AS OPIOID RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-07-13 | — | — | EP | claimed |
| EP-3112352-B1 | OPIOID RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-11-21 | — | — | EP | disclosed |
| EP-3112352-A1 | OPIOID RECEPTOR MODULATORS | Janssen Pharmaceutica NV (BE) | 2017-01-04 | — | — | EP | disclosed |
| EP-2653465-B1 | Opioid receptor modulators | JANSSEN PHARMACEUTICA NV (BE) | 2016-07-13 | — | — | EP | disclosed |
| EP-2573068-B9 | Process for preparing intermediates of compounds useful as opioid receptor modulators | JANSSEN PHARMACEUTICA NV (BE) | 2015-08-26 | — | — | EP | disclosed |
| EP-2573068-B1 | Process for preparing intermediates of compounds useful as opioid receptor modulators | JANSSEN PHARMACEUTICA NV (BE) | 2014-12-31 | — | — | EP | disclosed |
| EP-2653465-A1 | Opioid receptor modulators | Janssen Pharmaceutica NV (BE) | 2013-10-23 | — | — | EP | disclosed |
| EP-2298744-B1 | Opioid receptor modulators | JANSSEN PHARMACEUTICA NV (BE) | 2013-06-26 | — | — | EP | disclosed |
| EP-2573068-A1 | Process for preparing intermediates of compounds useful as opioid receptor modulators | Janssen Pharmaceutica NV (BE) | 2013-03-27 | — | — | EP | disclosed |
| EP-1725537-B1 | NOVEL COMPOUNDS AS OPIOID RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-07-13 | — | — | EP | disclosed |
| EP-2298744-A2 | Opioid receptor modulators | Janssen Pharmaceutica NV (BE) | 2011-03-23 | — | — | EP | disclosed |