Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.46 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8306633 | 0.92 | HSD17B10 (0.46) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL8305374 | 0.92 | HSD17B10 (0.50) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL15065607 | 0.90 | CXCR4 (0.54) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL15065509 | 0.84 | CXCR4 (0.55) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL12003 | 0.83 | CXCR4 (0.56) | HSD17B10CXCR4SIGMAR1RAD52POLB | |
| SCHEMBL11443013 | 0.83 | CXCR4 (0.56) | HSD17B10CXCR4SIGMAR1RAD52POLB | |
| SCHEMBL8306593 | 0.82 | ACE2 (0.57) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL18024011 | 0.82 | SCN5A (0.46) | SIGMAR1SMN1; SMN2PAOXACE2L3MBTL1 | |
| SCHEMBL15065371 | 0.82 | CXCR4 (0.59) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 | |
| SCHEMBL15065656 | 0.82 | CXCR4 (0.59) | HSD17B10CXCR4ANPEPERAP2SIGMAR1 |
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-2016130968-A1 | BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR | YALE UNIVERSITY (US) | 2016-08-18 | — | — | WO | disclosed |