Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564878 | 0.91 | HRH1 (0.49) | KCNH2SSTR5 | |
| SCHEMBL9564783 | 0.87 | CYP3A4 (0.39) | KCNH2 | |
| SCHEMBL10547724 | 0.82 | SLC6A9 (0.55) | NR4A2KCNH2SSTR5 | |
| Bromide SCHEMBL9564766 | 0.81 | KCNH2 (0.42) | NR4A2KCNH2 | |
| SCHEMBL9565008 | 0.80 | DRD2 (0.50) | KCNH2 | |
| SCHEMBL9539974 | 0.79 | KCNH2 (0.69) | NR4A2KCNH2SSTR5 | |
| SCHEMBL10553768 | 0.79 | KCNH2 (0.57) | NR4A2KCNH2SSTR5GRIN2BGRIN1 | |
| SCHEMBL9564927 | 0.79 | P2RX7 (0.44) | KCNH2 | |
| Water SCHEMBL9536552 | 0.78 | KCNH2 (0.56) | NR4A2KCNH2SSTR5GRIN2BGRIN1 | |
| SCHEMBL9564825 | 0.78 | HTR1A (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5258380-A | Antiallergens, antihistamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-11-02 | — | — | US | disclosed |
| US-5041448-A | Antiallergens | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-08-20 | — | — | US | disclosed |
| EP-0206415-A2 | (4-Piperidinylmethyl and -hetero)purines | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-12-30 | — | — | EP | disclosed |