Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.57 |
| ▸ | MC4R | P32245 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CCR3 | P51677 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 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 | |
|---|---|---|---|---|
| SCHEMBL17533381 | 0.86 | SLC6A3 (0.59) | SIGMAR1CCR3KMT2AMEN1MAPT | |
| SCHEMBL7270268 | 0.79 | SIGMAR1 (0.61) | SIGMAR1MC4RLMNAPOLBKMT2A | |
| SCHEMBL12493124 | 0.78 | SIGMAR1 (0.55) | SIGMAR1MC4RALDH1A1LMNAPOLB | |
| SCHEMBL927158 | 0.77 | SIGMAR1 (0.59) | SIGMAR1MC4RALDH1A1LMNAPOLB | |
| SCHEMBL9232557 | 0.77 | SIGMAR1 (0.59) | SIGMAR1MC4RALDH1A1LMNAPOLB | |
| SCHEMBL4726 | 0.76 | SIGMAR1 (0.68) | SIGMAR1MC4RLMNAPOLBKMT2A | |
| SCHEMBL11463836 | 0.75 | SIGMAR1 (0.55) | SIGMAR1MC4RALDH1A1LMNAPOLB | |
| SCHEMBL2489199 | 0.74 | SIGMAR1 (1.00) | SIGMAR1MC4RLMNAPOLBCCR3 | |
| SCHEMBL8188324 | 0.74 | SIGMAR1 (1.00) | SIGMAR1MC4RLMNAPOLBCCR3 | |
| SCHEMBL1415730 | 0.74 | SIGMAR1 (1.00) | SIGMAR1MC4RLMNAPOLBCCR3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016029218-A1 | SUBSTITUTED 1-ARYLETHYL-4-ACYLAMINOPIPERIDINE DERIVATIVES AS OPIOID/ALPHA-ADRENORECEPTOR MODULATORS AND METHOD OF THEIR PREPARATION | THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) | 2016-02-25 | — | — | WO | disclosed |