Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QPCT | Q16769 | 1/20 | 0.50 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.44 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.44 |
| ▸ | ITGAL | P20701 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11469152 | 0.79 | QPCT (0.50) | QPCTQPCTLCYP3A4SLC7A5HRH4 | |
| SCHEMBL15080457 | 0.79 | REN (0.54) | QPCTQPCTLCYP3A4SLC7A5HRH4 | |
| SCHEMBL468830 | 0.78 | ITGB2 (0.64) | QPCTQPCTLCYP3A4SLC7A5ALDH1A1 | |
| SCHEMBL15683044 | 0.78 | ITGB2 (0.64) | QPCTQPCTLCYP3A4SLC7A5ALDH1A1 | |
| SCHEMBL6026427 | 0.78 | ITGB2 (0.64) | QPCTQPCTLCYP3A4SLC7A5ALDH1A1 | |
| SCHEMBL11479809 | 0.78 | LTA4H (0.53) | CYP3A4SLC7A5REN | |
| Water SCHEMBL8680774 | 0.77 | ITGB2 (0.63) | QPCTQPCTLCYP3A4SLC7A5ALDH1A1 | |
| SCHEMBL5808674 | 0.75 | HTR1D (0.51) | QPCTQPCTLCYP3A4SLC7A5HRH4 | |
| SCHEMBL12632551 | 0.75 | REN (0.53) | QPCTQPCTLCYP3A4SLC7A5HRH4 | |
| SCHEMBL11614133 | 0.75 | QPCT (0.49) | QPCTQPCTLCYP3A4SLC7A5HRH4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4221914-A | ANTIHISTAMINES, HISTIDINE DECARBOXYLASE INHIBITORS | MERRELL TORAUDE ET COMPAGNIE (FR) | 1980-09-09 | — | — | US | disclosed |