Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 4/20 | 0.57 |
| ▸ | ACHE | P22303 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | ACACB | O00763 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23130335 | 0.86 | BCHE (0.68) | BCHEACHENPC1RAB9AACACB | |
| SCHEMBL11060563 | 0.76 | CYP1A2 (0.58) | BCHEACHENPC1RAB9ACYP1A2 | |
| SCHEMBL24116760 | 0.75 | MTNR1A (0.55) | BCHEACHENPC1RAB9ACYP1A2 | |
| SCHEMBL19999815 | 0.74 | KDM1A (0.44) | BCHEACHENPC1RAB9ALMNA | |
| SCHEMBL19999799 | 0.74 | KDM1A (0.40) | BCHEACHEKMT2A | |
| SCHEMBL21583954 | 0.74 | PTPN1 (0.47) | ALDH1A1TP53 | |
| SCHEMBL21494215 | 0.74 | SLC1A3 (0.53) | BCHEACHENPC1RAB9ACYP1A2 | |
| SCHEMBL24116761 | 0.74 | POLB (0.60) | BCHEACHENPC1RAB9ACYP1A2 | |
| SCHEMBL29746849 | 0.74 | SLC1A3 (0.53) | BCHEACHENPC1RAB9ACYP1A2 | |
| SCHEMBL18181364 | 0.74 | KDM1A (0.46) | BCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3286166-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK NO 5 LTD (GB) | 2020-05-13 | — | — | EP | disclosed |