Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 3/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PKLR | P30613 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.44 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16601377 | 0.84 | GRIN2B (0.53) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL16601375 | 0.84 | GRIN2B (0.53) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL16601372 | 0.84 | GRIN2B (0.53) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL20853636 | 0.84 | GRIN2B (0.53) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL4010484 | 0.84 | GRIN2B (0.54) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL7506800 | 0.81 | MEN1 (0.52) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL2880304 | 0.80 | SMN1; SMN2 (0.55) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL6161298 | 0.80 | MEN1 (0.50) | OPRK1OPRD1MEN1KMT2ANPSR1 | |
| SCHEMBL6213261 | 0.78 | GRIN2B (0.48) | GRIN2BOPRK1OPRD1MEN1KMT2A | |
| SCHEMBL748649 | 0.78 | MEN1 (0.46) | OPRK1OPRD1MEN1KMT2ANPSR1 |
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-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 |