Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.67 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15295194 | 0.87 | TMEM97 (0.66) | TMEM97SIGMAR1HTR1AHTR7CNR2 | |
| SCHEMBL8870438 | 0.87 | TMEM97 (0.66) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| SCHEMBL15283315 | 0.84 | TMEM97 (0.63) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| SCHEMBL9570355 | 0.83 | TMEM97 (0.62) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| SCHEMBL15292530 | 0.83 | TMEM97 (0.62) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| SCHEMBL9570335 | 0.83 | SIGMAR1 (0.71) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| Iodide SCHEMBL8869500 | 0.82 | TMEM97 (0.60) | TMEM97SIGMAR1HTR1AHTR7RAB9A | |
| Hydrochloric Acid SCHEMBL8869860 | 0.82 | SIGMAR1 (0.69) | TMEM97SIGMAR1HTR1AHTR7CYP1A2 | |
| SCHEMBL318427 | 0.80 | L3MBTL1 (0.68) | SIGMAR1RAB9AL3MBTL1NPC1CYP1A2 | |
| SCHEMBL3225943 | 0.79 | HTT (0.65) | TMEM97SIGMAR1L3MBTL1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5654323-A | 2-NITROGEN-CONTAINING FUNCTIONAL GROUP-HALOBENZOTHIAZOLES; ANALGESICS; ANTIINFLAMMATORY AND HYPOTENSIVE AGENTS; INHIBITORS OF CYTOKINES (INCLUDING TUMOR NECROSIS FACTOR) AND PHOSPHOLIPASE; SEPTIC SHOCK | ADIR ET COMPAGNIE (FR) | 1997-08-05 | — | — | US | disclosed |
| US-5597819-A | ANTIINFLAMMATORY AGENTS | ADIR ET COMPAGNIE (FR) | 1997-01-28 | — | — | US | disclosed |
| US-5550143-A | Heterocyclic compounds | ADIR ET COMPAGNIE (FR) | 1996-08-27 | — | — | US | disclosed |
| EP-0572308-A2 | Heterocyclic derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1993-12-01 | — | — | EP | disclosed |