Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 15/20 | 0.48 |
| ▸ | KDM1A | O60341 | 3/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 8/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 8/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | TOP1 | P11387 | 1/20 | 0.42 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7818101 | 0.84 | KIF11 (0.46) | NR3C1KDM1ACYP17A1PGRNR3C2 | |
| SCHEMBL7092115 | 0.78 | ALDH1A1 (0.51) | NR3C1CYP1A2RAB9A | |
| SCHEMBL12017964 | 0.75 | SMN1; SMN2 (0.67) | KDM1ACYP17A1SLC22A1ABCC4NR1I2 | |
| SCHEMBL7088720 | 0.74 | NR3C1 (0.46) | NR3C1TP53RAB9A | |
| SCHEMBL23547262 | 0.72 | CYP17A1 (0.56) | KDM1ACYP17A1KCNH2HSD17B10 | |
| SCHEMBL7093467 | 0.72 | ACHE (0.48) | TP53CYP3A4CYP2C9TSHRCASP1 | |
| SCHEMBL14561810 | 0.72 | BACE1 (0.54) | KDM1ACYP17A1SLC22A1ABCC4NR1I2 | |
| SCHEMBL23525739 | 0.72 | NR3C1 (0.56) | NR3C1KDM1ACYP17A1PGRNR3C2 | |
| SCHEMBL23547263 | 0.72 | NR3C1 (0.56) | NR3C1KDM1ACYP17A1PGRNR3C2 | |
| SCHEMBL23547250 | 0.72 | NR3C1 (0.56) | NR3C1KDM1ACYP17A1PGRNR3C2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0665843-B1 | SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS | PFIZER (US) | 2003-08-13 | — | — | EP | disclosed |
| US-5837711-A | Substituted quinuclidines as substance P antagonists | PFIZER INC. (US) | 1998-11-17 | — | — | US | disclosed |
| EP-0665843-A1 | SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1995-08-09 | — | — | EP | disclosed |
| WO-1994010170-A1 | SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1994-05-11 | — | — | WO | disclosed |