Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26003495 | 0.95 | CXCR4 (0.44) | SIGMAR1CXCR4CHRM2CHRM4CHRM5 | |
| SCHEMBL18024076 | 0.93 | SIGMAR1 (0.43) | SIGMAR1CXCR4CHRM2CHRM4CHRM5 | |
| SCHEMBL18024077 | 0.93 | CXCR4 (0.39) | SIGMAR1CXCR4POLBSMN1; SMN2HSD17B10 | |
| SCHEMBL20333695 | 0.91 | CXCR4 (0.50) | SIGMAR1CXCR4CHRM2CHRM4CHRM5 | |
| SCHEMBL18024014 | 0.83 | PAOX (0.43) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL11730463 | 0.83 | SIGMAR1 (0.48) | SIGMAR1SMN1; SMN2 | |
| SCHEMBL18024013 | 0.81 | SIGMAR1 (0.47) | SIGMAR1SMN1; SMN2 | |
| SCHEMBL18024035 | 0.81 | ALDH1A1 (0.40) | SIGMAR1CXCR4POLBSMN1; SMN2HSD17B10 | |
| SCHEMBL11922705 | 0.81 | CXCR4 (0.46) | SIGMAR1CXCR4CHRM2CHRM4CHRM5 | |
| SCHEMBL25134088 | 0.81 | SIGMAR1 (0.42) | SIGMAR1CXCR4CHRM2CHRM4CHRM5 |
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 |