Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19010251 | 0.84 | EPHX1 (0.40) | EPHX1SLC6A4SLC6A3KCNH2CACNA1I | |
| SCHEMBL19000030 | 0.82 | SLC6A4 (0.43) | EPHX1SLC6A4SLC6A3EPHX2 | |
| SCHEMBL23588513 | 0.79 | SAT1 (0.39) | EPHX1SLC6A3KCNH2CACNA1IEPHX2 | |
| SCHEMBL10274873 | 0.77 | KEAP1 (0.48) | EPHX1KMT2APIK3CAMTORSIGMAR1 | |
| SCHEMBL12252175 | 0.76 | — | — | |
| SCHEMBL29722243 | 0.76 | DRD2 (0.38) | SLC6A4SLC6A3KCNH2CACNA1ISMN1; SMN2 | |
| SCHEMBL17285624 | 0.75 | ADRA2A (0.42) | EPHX1KCNH2CACNA1IPRMT5WDR77 | |
| SCHEMBL25870704 | 0.75 | POLB (0.45) | KMT2APOLBRAB9AEPHX2 | |
| SCHEMBL29342170 | 0.74 | KDM1A (0.39) | EPHX1KCNH2CACNA1ISMN1; SMN2POLB | |
| SCHEMBL8019085 | 0.74 | PRMT5 (0.41) | SLC6A4SLC6A3KMT2ASMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017106607-A1 | POLYCYCLIC TLR7/8 ANTAGONISTS AND USE THEREOF IN THE TREATMENT OF IMMUNE DISORDERS | MERCK PATENT GMBH (DE) | 2017-06-22 | — | — | WO | disclosed |