Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.58 |
| ▸ | CHRNA5 | P30532 | 2/20 | 0.58 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | CNR1 | P21554 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16887920 | 0.86 | NR4A2 (0.52) | CHRNB2CHRNA5CHRNA7CHRNA4CYP1A2 | |
| SCHEMBL7276531 | 0.85 | CNR1 (0.56) | CHRNB2CHRNA5CHRNA7CHRNA4NPSR1 | |
| SCHEMBL7271018 | 0.85 | CNR1 (0.57) | CHRNB2CHRNA5CHRNA7CHRNA4CNR1 | |
| SCHEMBL7300604 | 0.80 | HTR4 (0.69) | CYP1A2CYP2C9ALOX15NFKB1PMP22 | |
| SCHEMBL7269469 | 0.79 | CYP2D6 (0.60) | CHRNB2CHRNA5CHRNA7CHRNA4CYP1A2 | |
| SCHEMBL8802608 | 0.79 | CHRNB2 (0.57) | CHRNB2CHRNA5CHRNA7CHRNA4 | |
| SCHEMBL7269463 | 0.79 | CYP2D6 (0.60) | CHRNB2CHRNA5CHRNA7CHRNA4CYP1A2 | |
| SCHEMBL7271039 | 0.79 | CYP2D6 (0.60) | CHRNB2CHRNA5CHRNA7CHRNA4CYP1A2 | |
| SCHEMBL9344429 | 0.78 | HTR4 (0.67) | CYP1A2CYP2C9ALOX15NFKB1PMP22 | |
| SCHEMBL7277894 | 0.78 | CYP2D6 (0.62) | CHRNB2CHRNA5CHRNA7CHRNA4CYP1A2 |
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-0429984-B1 | Indole derivatives | NISSHIN FLOUR MILLING CO (JP) | 1997-07-23 | — | — | EP | disclosed |
| US-5124324-A | Psychological disorders, 5-hydroxy tryptamine antagonists | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1992-06-23 | — | — | US | disclosed |
| EP-0429984-A2 | Indole derivatives | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1991-06-05 | — | — | EP | disclosed |