Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER1 | P34995 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18292660 | 0.79 | ALDH1A1 (0.54) | PTGER1NPC1DYRK1ABCHEACHE | |
| SCHEMBL11426520 | 0.72 | HRH1 (0.46) | PTGER1DRD4HRH1HRH2HRH3 | |
| SCHEMBL11857905 | 0.71 | ACHE (0.42) | NPC1DRD4BCHEACHEDRD2 | |
| SCHEMBL23889226 | 0.71 | SETD7 (0.45) | DRD4DYRK1AHRH1HRH2HRH4 | |
| SCHEMBL8063320 | 0.70 | NPC1 (0.65) | NPC1DYRK1ANPY5RCYP19A1CYP11B2 | |
| SCHEMBL12568363 | 0.69 | PTGER1 (0.72) | PTGER1BCHEACHEKDM4EALDH1A1 | |
| SCHEMBL14825944 | 0.69 | DRD4 (0.56) | NPC1DRD4NPY5RHRH1HRH2 | |
| Methane SCHEMBL8064257 | 0.69 | NPC1 (0.64) | NPC1DYRK1ANPY5RCYP19A1CYP11B2 | |
| SCHEMBL7089728 | 0.67 | NPC1 (0.81) | NPC1DRD4NPY5RCYP19A1CYP11B2 | |
| SCHEMBL17483475 | 0.66 | DRD4 (0.45) | DRD4DYRK1AHRH1HRH2HRH4 |
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-0673782-B1 | Recording sheets containing pyrrole, pyrrolidine, pyridine, piperidine, homopiperidine, quinoline, isoquinoline, quinuclidine, indole, and indazole compounds | XEROX CORP (US) | 2000-06-14 | — | — | EP | claimed |
| US-3957816-A | ANTI-FERTILITY AGENTS | SANDOZ, INC. (US) | 1976-05-18 | — | — | US | disclosed |
| US-3932430-A | Substituted indeno, naphtho and cyclohepta pyrazoles | SANDOZ, INC. (US) | 1976-01-13 | — | — | US | disclosed |