Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 1/20 | 0.58 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.49 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7504527 | 0.90 | ALDH1A1 (0.60) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL2587746 | 0.90 | ALDH1A1 (0.50) | NOS2OPRK1OPRD1CYP4F2CYP4A11 | |
| SCHEMBL751049 | 0.87 | OPRD1 (0.53) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL2582728 | 0.87 | TACR1 (0.51) | NOS2OPRK1OPRD1CYP4F2CYP4A11 | |
| SCHEMBL7556949 | 0.87 | CHRM4 (0.61) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL2885113 | 0.85 | NOS2 (0.61) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL4159590 | 0.82 | NOS2 (0.58) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL7284050 | 0.82 | OPRM1 (0.58) | NOS2OPRK1OPRD1CHRM4MEN1 | |
| SCHEMBL750075 | 0.82 | L3MBTL1 (0.54) | NOS2OPRK1OPRD1MEN1KMT2A | |
| SCHEMBL8316171 | 0.82 | MEN1 (0.47) | NOS2OPRK1OPRD1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1061977-C | Aryl substituted heterocycles | ZENECA LTD (GB) | 2001-02-14 | — | — | CN | disclosed |
| EP-0630887-B1 | 4-(aryl-substituted)-piperidines as neurokinin receptor antagonists | ZENECA LTD (GB) | 1999-07-28 | — | — | EP | disclosed |
| US-5654299-A | TREATING RESPIRATORY SYSTEM DISORDER (I.E. ASTHMA) WITH NEUROKININ 2 RECEPTOR ANTAGONIST | ZENECA LIMITED (GB) | 1997-08-05 | — | — | US | disclosed |
| EP-0630887-A1 | 4-(aryl-substituted)-piperidines as neurokinin receptor antagonists | ZENECA LIMITED (GB) | 1994-12-28 | — | — | EP | disclosed |